Diisobutylcarbinol (CAS 108-82-7) — formula C9H20O, molecular weight 144.25; category organic chemicals.
| CAS Number | 108-82-7 |
|---|---|
| Molecular Formula | C9H20O |
| Molecular Weight | 144.25 |
| Melting Point | -85 °F (USCG, 1999) |
| Boiling Point | 352 °F at 760 mmHg (USCG, 1999) |
| LogP | 3 |
| Applications | Uses: Used as solvent for coating compositions of urea or melamine resins and to make lubricant additives and plasticizers, Also used in surface-active agents, rubber chemicals, flotation agents, antifoam agents, and flavors, [HSDB], AS SOLVENT FOR COATING COMPOSITIONS OF UREA OR MELAMINE RESINS & FOR PREPN OF LUBRICANT ADDITIVES & PLASTICIZERS, SURFACE-ACTIVE AGENTS, LUBRICANT ADDITIVES, RUBBER CHEMICALS, FLOTATION AGENTS, ANTIFOAM AGENT, FLAVORING INGREDIENT, REACTION MEDIUM FOR HYDROGEN PEROXIDE PRODUCTION, DEFOAMER, Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Solvent, Not Known or Reasonably Ascertainable, Intermediate, Consumer Uses: Not Known or Reasonably Ascertainable, Methods of Manufacturing: REDUCTION OF DIISOBUTYL KETONE, U.S. Production: 2023: 4, 000, 000 - <5, 500, 000 lb, 2022: 4, 2021: 5, 000 - <7, 2020: 4, (1977) NOT PRODUCED COMMERCIALLY IN US, (1979) NOT PRODUCED COMMERCIALLY IN US, U.S. Imports: (1977) No Data, (1979) No Data, U.S. Exports: (1977) No Data, General Manufacturing Information: All Other Basic Organic Chemical Manufacturing, Paint and Coating Manufacturing, 4-Heptanol, 2, 6-dimethyl-: ACTIVE, FEMA NUMBER 3140, REPORTED USES: IN NON-ALCOHOLIC BEVERAGES, ICE CREAMS, ICES, CANDY, GELATINS & PUDDINGS, CHEWING GUM: 20.0 PPM. |
| Category | Organic Chemicals |
Documented applications: Uses: Used as solvent for coating compositions of urea or melamine resins and to make lubricant additives and plasticizers, Also used in surface-active agents, rubber chemicals, flotation agents, antifoam agents, and flavors, [HSDB], AS SOLVENT FOR COATING COMPOSITIONS OF UREA OR MELAMINE RESINS & FOR PREPN OF LUBRICANT ADDITIVES & PLASTICIZERS, SURFACE-ACTIVE AGENTS, LUBRICANT ADDITIVES, RUBBER CHEMICALS, FLOTATION AGENTS, ANTIFOAM AGENT, FLAVORING INGREDIENT, REACTION MEDIUM FOR HYDROGEN PEROXIDE PRODUCTION, DEFOAMER, Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Solvent, Not Known or Reasonably Ascertainable, Intermediate, Consumer Uses: Not Known or Reasonably Ascertainable, Methods of Manufacturing: REDUCTION OF DIISOBUTYL KETONE, U.S. Production: 2023: 4, 000, 000 - <5, 500, 000 lb, 2022: 4, 2021: 5, 000 - <7, 2020: 4, (1977) NOT PRODUCED COMMERCIALLY IN US, (1979) NOT PRODUCED COMMERCIALLY IN US, U.S. Imports: (1977) No Data, (1979) No Data, U.S. Exports: (1977) No Data, General Manufacturing Information: All Other Basic Organic Chemical Manufacturing, Paint and Coating Manufacturing, 4-Heptanol, 2, 6-dimethyl-: ACTIVE, FEMA NUMBER 3140, REPORTED USES: IN NON-ALCOHOLIC BEVERAGES, ICE CREAMS, ICES, CANDY, GELATINS & PUDDINGS, CHEWING GUM: 20.0 PPM..
Diisobutylcarbinol is a carbon-based organic compound with CAS registry number 108-82-7 and molecular formula C9H20O (molecular weight 144.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 108-82-7
Its molecular formula C9H20O comprises 9 C, 20 H, 1 O atoms.
Also known as: Diisobutylcarbinol · 二异丁基甲醇
Category: organic chemicals
The CAS registry number of Diisobutylcarbinol is 108-82-7.
Molecular formula C9H20O, molecular weight 144.25.
It is also registered under: Diisobutylcarbinol, 二异丁基甲醇.
Recorded applications: Uses: Used as solvent for coating compositions of urea or melamine resins and to make lubricant additives and plasticizers, Also used in surface-active agents, rubber chemicals, flotation agents, antifoam agents, and flavors, [HSDB], AS SOLVENT FOR COATING COMPOSITIONS OF UREA OR MELAMINE RESINS & FOR PREPN OF LUBRICANT ADDITIVES & PLASTICIZERS, SURFACE-ACTIVE AGENTS, LUBRICANT ADDITIVES, RUBBER CHEMICALS, FLOTATION AGENTS, ANTIFOAM AGENT, FLAVORING INGREDIENT, REACTION MEDIUM FOR HYDROGEN PEROXIDE PRODUCTION, DEFOAMER, Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Solvent, Not Known or Reasonably Ascertainable, Intermediate, Consumer Uses: Not Known or Reasonably Ascertainable, Methods of Manufacturing: REDUCTION OF DIISOBUTYL KETONE, U.S. Production: 2023: 4, 000, 000 - <5, 500, 000 lb, 2022: 4, 2021: 5, 000 - <7, 2020: 4, (1977) NOT PRODUCED COMMERCIALLY IN US, (1979) NOT PRODUCED COMMERCIALLY IN US, U.S. Imports: (1977) No Data, (1979) No Data, U.S. Exports: (1977) No Data, General Manufacturing Information: All Other Basic Organic Chemical Manufacturing, Paint and Coating Manufacturing, 4-Heptanol, 2, 6-dimethyl-: ACTIVE, FEMA NUMBER 3140, REPORTED USES: IN NON-ALCOHOLIC BEVERAGES, ICE CREAMS, ICES, CANDY, GELATINS & PUDDINGS, CHEWING GUM: 20.0 PPM..
Category: Organic Chemicals.
Independent reference data for Diisobutylcarbinol (CAS 108-82-7), compiled from public chemistry databases.
| CAS Registry Number | 108-82-7 |
|---|---|
| PubChem CID | 7957 |
| Molecular formula | C9H20O |
| IUPAC name | 2,6-dimethylheptan-4-ol |
| UNII (FDA) | X5ATE41R0F |
| FEMA number | 3140 |
| JECFA number | 303 |
| Molecular Weight | 144.25 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 144.151415257 |
| Monoisotopic Mass | 144.151415257 |
| Topological Polar Surface Area | 20.2 |
| Heavy Atom Count | 10 |
| Boiling Point | 352 °F at 760 mmHg (USCG, 1999) |
|---|---|
| Boiling Point | 176-177 °C @ 760 MM HG |
| Boiling Point | 174.00 to 178.00 °C. @ 760.00 mm Hg |
| Boiling Point | 178 °C |
| Melting Point | -85 °F (USCG, 1999) |
| Flash Point | 165 °F (USCG, 1999) |
| Flash Point | 162 °F OC |
| Solubility | 0.445 mg/mL at 25 °C |
| Density | 0.809 @ 21 °C/4 °C |
| Density | 0.809-0.815 (20 °C) |
2,6-Dimethylheptan-4-ol; 108-82-7; 2,6-Dimethyl-4-heptanol; Diisobutylcarbinol; DIISOBUTYL CARBINOL; 4-Heptanol, 2,6-dimethyl-; FEMA No. 3140; 4-Hydroxy-2,6-dimethyl heptane; Nonyl alcohol, secondary; DTXSID8026802; X5ATE41R0F; DTXCID006802; NSC-62683; RefChem:83294; 203-619-6; sec-Nonyl alcohol
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Green No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 86.4% (1591 / 1841) |
| GHS notification summary | 86.4% (1591 / 1841) |
|---|---|
| Reported hazard statements | H319 (12.5%), H335 (10.9%), H336 (11.5%), H412 (12.9%), H227, H320 |
This chemical does not meet GHS hazard criteria for 86.4% (1591 of 1841) of all reports.
H319 (12.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Diisobutylcarbinol · CAS 108-82-7 · C9H20O. UNII X5ATE41R0F. Boiling Point: 352 °F at 760 mmHg (USCG, 1999); Boiling Point: 176-177 °C @ 760 MM HG; Boiling Point: 174.00 to 178.00 °C. @ 760.00 mm Hg.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 二异丁基甲醇