异辛醇（CAS 104-76-7）：分子式 C8H18O、分子量 130.23。
| CAS号 | 104-76-7 |
|---|---|
| 分子式 | C8H18O |
| 分子量 | 130.23 |
| 熔点 | -105 °F (NTP, 1992) |
| 沸点 | 363 to 365 °F at 760 mmHg (NTP, 1992) |
| LogP | 3.1 |
| 应用领域 | Uses: Used as a plasticizer、defoaming agent、wetting agent、solvent (nitrocellulose、paints、lacquers、and baking finishes)、and textile finishing compound、Also used in inks、rubber、paper、lubricants、photography、and dry cleaning、[Hawley]、Pulp and Paper Processing [Category: Industry]、Painting (Solvents) [Category: Paint]、Dry Cleaning [Category: Clean]、Photographic Processing [Category: Other]、Textiles (Printing、Dyeing、or Finishing) [Category: Industry]、USE A sensitive method for the extraction and determination of polycyclic aromatic hydrocarbons (PAHs) using alcoholic-assisted dispersive liquid-liquid microextraction (AA-DLLME) and HPLC was developed... The effective parameters (type and volume of extraction and dispersive solvents、amount of salt and stirring time) on the extraction recovery were studied and optimized utilizing factorial design (FD) and central composite design (CCD). The best recovery was achieved by FD using 2-ethyl-1-hexanol as the extraction solvent and methanol as the dispersive solvent... The optimized conditions were 145 uL of 2-ethyl-1-hexanol as the extraction solvent and 4.2% w、v of salt (NaCl) in sample solution...、For 2-ethyl-1-hexanol (USEPA、OPP Pesticide Code: 079098) there are 0 labels match.、SRP: Not registered for current use in the U.S.、but approved pesticide uses may change periodically and so federal、state and local authorities must be consulted for currently approved uses.、2-Ethylhexanol is mainly used as the alcohol component for the manufacture of ester plasticizers for soft poly(vinyl chloride) (PVC).、Mercerizing textiles、as solvent for dyes、resins、oils、also claimed to possess antifoaming properties.、Plasticizer for PVC resins、organic synthesis、solvent mixtures for nitrocellulose、baking finishes ... Inks、dry cleaning、Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENTFood Additives -> ADJUVANT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、METABOLITE-DEHPS、Industry Uses: Processing aids not otherwise specified、Monomers、Surfactant (surface active agent)、Fuel agents、Fuel、Solvent、Dispersing agent、CBI、Chain transfer agent、Adhesion、cohesion promoter、Intermediate、Dye、Plasticizer、Cleaning agent、Filler、Not Known or Reasonably Ascertainable、Corrosion inhibitor、Emulsifier、Consumer Uses: Fuel、Household Products: Information on 24 consumer products that contain 2-Ethylhexanol in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Home Maintenance、• Inside the Home、Methods of Manufacturing: 2-Ethyl hexanol is produced in 4 steps: (1) aldolization of butyraldehyde and subsequent dehydration、(2) separation of aldolization solution、(3) hydrogenation of unsaturated 2-ethyl-2-hexenal as an intermediate product、(4) fractionation of 2-ethylhexanol. The butyraldehyde required for the aldolization stage is made by hydroformylation of propene.、(A) Oxo process、from propylene and synthesis gas. (B) Aldolization of acetaldehyde or butyraldehyde、followed by hydrogenation. (C) From fermentation alcohol.、HYDROGENATION OF 2-ETHYL-1-HEXENAL AT 200 °C USING A COPPER OR NICKEL CATALYST、Formulations、Preparations: Grade: Technical.、Liquid grade、99% grade、99.5% grade、Consumption Patterns: 78% As a chem int for vinyl plasticizers、10% as a chem int for 2-ethylhexyl acrylate、12% in other applcns (1975)、CHEMICAL PROFILE: 2-Ethylhexanol. Plasticizers、49%、(dioctyl phthalate、36%、dioctyl adipate、6%、trioctyltrimellitate、4%、other plasticizers、3%)、2-ethylhexyl acrylate、13%、2-ethylhexyl nitrate (cetane improver)、5%、lube additive、3%、surfactant、1%、miscellaneous、exports、25%.、CHEMICAL PROFILE: 2-Ethylhexanol. Demand: 1986: 570 million lb、1987: 630 million lb、1991、projected、: 615 million lb (includes exports、but not imports、which were 43 million lb in 1986).、Plasticizers、60% (dioctyl phthalate、38%、7%、trioctyl trimellitate、including dioctyl terephthalate、9%)、17%、solvent、2%、including mining applications、7%.、U.S. Production: 2023: 1、000、000 - <2、500、000 lb、2022: 1、2021: 1、2020: 1、(1972) 2.27X10+11 GRAMS、(1975) 1.76X10+11 GRAMS、Demand 685 million pounds in 1992 and 700 million pounds in 1993. (Includes exports、but not imports)、1-Hexanol、2-ethyl- is listed as a High Production Volume (HPV) chemical (65FR81686). Chemicals listed as HPV were produced in or imported into the U.S. in >1 million pounds in 1990 and、or 1994. The HPV list is based on the 1990 Inventory Update Rule. (IUR) (40 CFR part 710 subpart B、51FR21438).、For more U.S. Production (Complete) data for 2-ETHYL-1-HEXANOL (7 total)、please visit the HSDB record page.、U.S. Imports: (1972) NEGLIGIBLE、(1993) 20 million pounds、U.S. Exports: 85 to 150 pounds per year.、General Manufacturing Information: Fabricated Metal Product Manufacturing、Plastics Material and Resin Manufacturing、Paint and Coating Manufacturing、Petroleum Refineries、Adhesive Manufacturing、All Other Chemical Product and Preparation Manufacturing、Wood Product Manufacturing、Petrochemical Manufacturing、Miscellaneous Manufacturing、Asphalt Paving、Roofing、and Coating Materials Manufacturing、Other (requires additional information)、All Other Basic Organic Chemical Manufacturing、Textiles、apparel、and leather manufacturing、Mining (except Oil and Gas) and support activities、All Other Basic Inorganic Chemical Manufacturing、Pe |
登记用途：Uses: Used as a plasticizer、defoaming agent、wetting agent、solvent (nitrocellulose、paints、lacquers、and baking finishes)、and textile finishing compound、Also used in inks、rubber、paper、lubricants、photography、and dry cleaning、[Hawley]、Pulp and Paper Processing [Category: Industry]、Painting (Solvents) [Category: Paint]、Dry Cleaning [Category: Clean]、Photographic Processing [Category: Other]、Textiles (Printing、Dyeing、or Finishing) [Category: Industry]、USE A sensitive method for the extraction and determination of polycyclic aromatic hydrocarbons (PAHs) using alcoholic-assisted dispersive liquid-liquid microextraction (AA-DLLME) and HPLC was developed... The effective parameters (type and volume of extraction and dispersive solvents、amount of salt and stirring time) on the extraction recovery were studied and optimized utilizing factorial design (FD) and central composite design (CCD). The best recovery was achieved by FD using 2-ethyl-1-hexanol as the extraction solvent and methanol as the dispersive solvent... The optimized conditions were 145 uL of 2-ethyl-1-hexanol as the extraction solvent and 4.2% w、v of salt (NaCl) in sample solution...、For 2-ethyl-1-hexanol (USEPA、OPP Pesticide Code: 079098) there are 0 labels match.、SRP: Not registered for current use in the U.S.、but approved pesticide uses may change periodically and so federal、state and local authorities must be consulted for currently approved uses.、2-Ethylhexanol is mainly used as the alcohol component for the manufacture of ester plasticizers for soft poly(vinyl chloride) (PVC).、Mercerizing textiles、as solvent for dyes、resins、oils、also claimed to possess antifoaming properties.、Plasticizer for PVC resins、organic synthesis、solvent mixtures for nitrocellulose、baking finishes ... Inks、dry cleaning、Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENTFood Additives -> ADJUVANT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、METABOLITE-DEHPS、Industry Uses: Processing aids not otherwise specified、Monomers、Surfactant (surface active agent)、Fuel agents、Fuel、Solvent、Dispersing agent、CBI、Chain transfer agent、Adhesion、cohesion promoter、Intermediate、Dye、Plasticizer、Cleaning agent、Filler、Not Known or Reasonably Ascertainable、Corrosion inhibitor、Emulsifier、Consumer Uses: Fuel、Household Products: Information on 24 consumer products that contain 2-Ethylhexanol in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Home Maintenance、• Inside the Home、Methods of Manufacturing: 2-Ethyl hexanol is produced in 4 steps: (1) aldolization of butyraldehyde and subsequent dehydration、(2) separation of aldolization solution、(3) hydrogenation of unsaturated 2-ethyl-2-hexenal as an intermediate product、(4) fractionation of 2-ethylhexanol. The butyraldehyde required for the aldolization stage is made by hydroformylation of propene.、(A) Oxo process、from propylene and synthesis gas. (B) Aldolization of acetaldehyde or butyraldehyde、followed by hydrogenation. (C) From fermentation alcohol.、HYDROGENATION OF 2-ETHYL-1-HEXENAL AT 200 °C USING A COPPER OR NICKEL CATALYST、Formulations、Preparations: Grade: Technical.、Liquid grade、99% grade、99.5% grade、Consumption Patterns: 78% As a chem int for vinyl plasticizers、10% as a chem int for 2-ethylhexyl acrylate、12% in other applcns (1975)、CHEMICAL PROFILE: 2-Ethylhexanol. Plasticizers、49%、(dioctyl phthalate、36%、dioctyl adipate、6%、trioctyltrimellitate、4%、other plasticizers、3%)、2-ethylhexyl acrylate、13%、2-ethylhexyl nitrate (cetane improver)、5%、lube additive、3%、surfactant、1%、miscellaneous、exports、25%.、CHEMICAL PROFILE: 2-Ethylhexanol. Demand: 1986: 570 million lb、1987: 630 million lb、1991、projected、: 615 million lb (includes exports、but not imports、which were 43 million lb in 1986).、Plasticizers、60% (dioctyl phthalate、38%、7%、trioctyl trimellitate、including dioctyl terephthalate、9%)、17%、solvent、2%、including mining applications、7%.、U.S. Production: 2023: 1、000、000 - <2、500、000 lb、2022: 1、2021: 1、2020: 1、(1972) 2.27X10+11 GRAMS、(1975) 1.76X10+11 GRAMS、Demand 685 million pounds in 1992 and 700 million pounds in 1993. (Includes exports、but not imports)、1-Hexanol、2-ethyl- is listed as a High Production Volume (HPV) chemical (65FR81686). Chemicals listed as HPV were produced in or imported into the U.S. in >1 million pounds in 1990 and、or 1994. The HPV list is based on the 1990 Inventory Update Rule. (IUR) (40 CFR part 710 subpart B、51FR21438).、For more U.S. Production (Complete) data for 2-ETHYL-1-HEXANOL (7 total)、please visit the HSDB record page.、U.S. Imports: (1972) NEGLIGIBLE、(1993) 20 million pounds、U.S. Exports: 85 to 150 pounds per year.、General Manufacturing Information: Fabricated Metal Product Manufacturing、Plastics Material and Resin Manufacturing、Paint and Coating Manufacturing、Petroleum Refineries、Adhesive Manufacturing、All Other Chemical Product and Preparation Manufacturing、Wood Product Manufacturing、Petrochemical Manufacturing、Miscellaneous Manufacturing、Asphalt Paving、Roofing、and Coating Materials Manufacturing、Other (requires additional information)、All Other Basic Organic Chemical Manufacturing、Textiles、apparel、and leather manufacturing、Mining (except Oil and Gas) and support activities、All Other Basic Inorganic Chemical Manufacturing、Pe。
异辛醇 是一种化工化合物，登记 CAS 号为 104-76-7，分子式 C8H18O（分子量 130.23）。
登记 CAS 号：104-76-7
其分子式 C8H18O 由 8 个碳、18 个氢、1 个氧 组成。
别名/同义词：异辛醇 · 2-Ethyl-1-hexanol · 2-ETHYLHEXANOL
异辛醇 的 CAS 登记号为 104-76-7。
分子式 C8H18O，分子量 130.23。
别名/同义词：异辛醇、2-Ethyl-1-hexanol、2-ETHYLHEXANOL。
登记用途：Uses: Used as a plasticizer、defoaming agent、wetting agent、solvent (nitrocellulose、paints、lacquers、and baking finishes)、and textile finishing compound、Also used in inks、rubber、paper、lubricants、photography、and dry cleaning、[Hawley]、Pulp and Paper Processing [Category: Industry]、Painting (Solvents) [Category: Paint]、Dry Cleaning [Category: Clean]、Photographic Processing [Category: Other]、Textiles (Printing、Dyeing、or Finishing) [Category: Industry]、USE A sensitive method for the extraction and determination of polycyclic aromatic hydrocarbons (PAHs) using alcoholic-assisted dispersive liquid-liquid microextraction (AA-DLLME) and HPLC was developed... The effective parameters (type and volume of extraction and dispersive solvents、amount of salt and stirring time) on the extraction recovery were studied and optimized utilizing factorial design (FD) and central composite design (CCD). The best recovery was achieved by FD using 2-ethyl-1-hexanol as the extraction solvent and methanol as the dispersive solvent... The optimized conditions were 145 uL of 2-ethyl-1-hexanol as the extraction solvent and 4.2% w、v of salt (NaCl) in sample solution...、For 2-ethyl-1-hexanol (USEPA、OPP Pesticide Code: 079098) there are 0 labels match.、SRP: Not registered for current use in the U.S.、but approved pesticide uses may change periodically and so federal、state and local authorities must be consulted for currently approved uses.、2-Ethylhexanol is mainly used as the alcohol component for the manufacture of ester plasticizers for soft poly(vinyl chloride) (PVC).、Mercerizing textiles、as solvent for dyes、resins、oils、also claimed to possess antifoaming properties.、Plasticizer for PVC resins、organic synthesis、solvent mixtures for nitrocellulose、baking finishes ... Inks、dry cleaning、Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENTFood Additives -> ADJUVANT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、METABOLITE-DEHPS、Industry Uses: Processing aids not otherwise specified、Monomers、Surfactant (surface active agent)、Fuel agents、Fuel、Solvent、Dispersing agent、CBI、Chain transfer agent、Adhesion、cohesion promoter、Intermediate、Dye、Plasticizer、Cleaning agent、Filler、Not Known or Reasonably Ascertainable、Corrosion inhibitor、Emulsifier、Consumer Uses: Fuel、Household Products: Information on 24 consumer products that contain 2-Ethylhexanol in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Home Maintenance、• Inside the Home、Methods of Manufacturing: 2-Ethyl hexanol is produced in 4 steps: (1) aldolization of butyraldehyde and subsequent dehydration、(2) separation of aldolization solution、(3) hydrogenation of unsaturated 2-ethyl-2-hexenal as an intermediate product、(4) fractionation of 2-ethylhexanol. The butyraldehyde required for the aldolization stage is made by hydroformylation of propene.、(A) Oxo process、from propylene and synthesis gas. (B) Aldolization of acetaldehyde or butyraldehyde、followed by hydrogenation. (C) From fermentation alcohol.、HYDROGENATION OF 2-ETHYL-1-HEXENAL AT 200 °C USING A COPPER OR NICKEL CATALYST、Formulations、Preparations: Grade: Technical.、Liquid grade、99% grade、99.5% grade、Consumption Patterns: 78% As a chem int for vinyl plasticizers、10% as a chem int for 2-ethylhexyl acrylate、12% in other applcns (1975)、CHEMICAL PROFILE: 2-Ethylhexanol. Plasticizers、49%、(dioctyl phthalate、36%、dioctyl adipate、6%、trioctyltrimellitate、4%、other plasticizers、3%)、2-ethylhexyl acrylate、13%、2-ethylhexyl nitrate (cetane improver)、5%、lube additive、3%、surfactant、1%、miscellaneous、exports、25%.、CHEMICAL PROFILE: 2-Ethylhexanol. Demand: 1986: 570 million lb、1987: 630 million lb、1991、projected、: 615 million lb (includes exports、but not imports、which were 43 million lb in 1986).、Plasticizers、60% (dioctyl phthalate、38%、7%、trioctyl trimellitate、including dioctyl terephthalate、9%)、17%、solvent、2%、including mining applications、7%.、U.S. Production: 2023: 1、000、000 - <2、500、000 lb、2022: 1、2021: 1、2020: 1、(1972) 2.27X10+11 GRAMS、(1975) 1.76X10+11 GRAMS、Demand 685 million pounds in 1992 and 700 million pounds in 1993. (Includes exports、but not imports)、1-Hexanol、2-ethyl- is listed as a High Production Volume (HPV) chemical (65FR81686). Chemicals listed as HPV were produced in or imported into the U.S. in >1 million pounds in 1990 and、or 1994. The HPV list is based on the 1990 Inventory Update Rule. (IUR) (40 CFR part 710 subpart B、51FR21438).、For more U.S. Production (Complete) data for 2-ETHYL-1-HEXANOL (7 total)、please visit the HSDB record page.、U.S. Imports: (1972) NEGLIGIBLE、(1993) 20 million pounds、U.S. Exports: 85 to 150 pounds per year.、General Manufacturing Information: Fabricated Metal Product Manufacturing、Plastics Material and Resin Manufacturing、Paint and Coating Manufacturing、Petroleum Refineries、Adhesive Manufacturing、All Other Chemical Product and Preparation Manufacturing、Wood Product Manufacturing、Petrochemical Manufacturing、Miscellaneous Manufacturing、Asphalt Paving、Roofing、and Coating Materials Manufacturing、Other (requires additional information)、All Other Basic Organic Chemical Manufacturing、Textiles、apparel、and leather manufacturing、Mining (except Oil and Gas) and support activities、All Other Basic Inorganic Chemical Manufacturing、Pe。
异辛醇（CAS 104-76-7）的独立参考数据，整理自公开化学数据库。
| CAS 号 | 104-76-7 |
|---|---|
| PubChem CID | 7720 |
| 分子式 | C8H18O |
| 分子量 | 130.14 g/mol |
| IUPAC 名称 | 2-ethylhexan-1-ol |
| InChIKey | YIWUKEYIRIRTPP-UHFFFAOYSA-N |
| UNII（FDA） | XZV7TAA77P |
| ChEBI 编号 | CHEBI:16011 |
| FEMA 编号 | 3151 |
| JECFA 编号 | 267 |
| Molecular Weight | 130.23 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 5 |
| Exact Mass | 130.135765193 |
| Monoisotopic Mass | 130.135765193 |
| Topological Polar Surface Area | 20.2 |
| Heavy Atom Count | 9 |
| Boiling Point | 363 to 365 °F at 760 mmHg (NTP, 1992) |
|---|---|
| Boiling Point | 184.34 °C |
| Boiling Point | 184.00 to 186.00 °C. @ 760.00 mm Hg |
| Boiling Point | 182 °C |
| Boiling Point | 183 °C |
| Boiling Point | 363-365 °F |
| Boiling Point | 184.6 °C @760 [mm Hg] |
| Melting Point | -105 °F (NTP, 1992) |
| Melting Point | -70 °C |
| Melting Point | -76.00 °C. @ 760.00 mm Hg |
2-Ethylhexan-1-ol; 2-Ethylhexanol; 2-ETHYL-1-HEXANOL; 104-76-7; 2-Ethylhexyl alcohol; 1-Hexanol, 2-ethyl-; Ethylhexanol; 2-ETHYL HEXANOL; 2-Aethylhexanol; Alcohol, 2-ethylhexyl; FEMA No. 3151; DTXSID5020605; XZV7TAA77P; NSC-9300; DTXCID10605; CHEBI:16011
| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT FDA Cumulative Estimated Daily Intake (CEDI): FCS FDA 21 CFR 中列出的食品接触物质清单：FCS FDA Inventory of Effective Food Contact Substance (FCS) Noti: FCS Flavoring Agents |
|---|---|
| GHS 通报统计 | 0.7% (26 / 3744) |
| GHS 通报统计 | 0.7% (26 / 3744) |
|---|---|
| 已通报的危害声明 | H315 (88.6%), H319 (98.7%), H332 (71.2%), H335 (72.5%), H402, H227, H336, H361 |
异辛醇 的 CAS 号为 104-76-7，分子式 C8H18O，分子量 130.14 g/mol。 UNII XZV7TAA77P; ChEBI 16011; InChIKey YIWUKEYIRIRTPP-UHFFFAOYSA-N. Boiling Point: 363 to 365 °F at 760 mmHg (NTP, 1992); Boiling Point: 184.34 °C; Boiling Point: 184.00 to 186.00 °C. @ 760.00 mm Hg.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: 2-Ethyl-1-hexanol