Isoflurane (CAS 26675-46-7) — formula C3H2ClF5O, molecular weight 184.49; category organic chemicals.
| CAS Number | 26675-46-7 |
|---|---|
| Molecular Formula | C3H2ClF5O |
| Molecular Weight | 184.49 |
| Melting Point | 48-48.5 |
| Boiling Point | 48.5 |
| LogP | 2.1 |
| Applications | Uses: Used as a special solvent and as an inhalation anesthetic, [Merck Index] A stable, non-explosive inhalation anesthetic, relatively free from significant side effects. [ChemIDplus], Solvent and dispersant for fluorinated materials, MEDICATION, MEDICATION (VET), Use (kg) in Switzerland (2009): >750, Use (kg, approx.) in Germany (2009): >10000, Consumption (g per capita) in Switzerland (2009): 0.096, Consumption (g per capita, approx.) in Germany (2009): 0.12, Excretion rate: 1, Calculated removal (%): 91.9, For induction and maintenance of general anesthesia., Use Classification: Animal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients, Methods of Manufacturing: Trifluoroethanol is methylated with dimethyl sulfate to form the methyl ether, which is then chlorinated to the dichloromethyl ether ... This latter compound, on treatment with HF, SbCl5 forms the product., Isoflurane is prepared by chlorination of 2, 2, 2-trifluoroethoxydifluoromethane, itself obtained by alkylation of trifluoroethanol with difluorochloromethane., Preparation: Croix, Terrell, DE 1814962 (1969), US 3535425 (both to Air Reduction), Formulations, Preparations: FORANE (isoflurane, USP) is also supplied in the, 250 mL, aluminum bottles., FORANE (isoflurane, USP) is packaged in 100 mL and 250 mL amber-colored bottles., Isoflurane USP is packaged in 250mL (NDC 66794-013-25) and 100mL (NDC 66794-013-10) amber-colored bottles., Vet |
| Category | Organic Chemicals |
Documented applications: Uses: Used as a special solvent and as an inhalation anesthetic, [Merck Index] A stable, non-explosive inhalation anesthetic, relatively free from significant side effects. [ChemIDplus], Solvent and dispersant for fluorinated materials, MEDICATION, MEDICATION (VET), Use (kg) in Switzerland (2009): >750, Use (kg, approx.) in Germany (2009): >10000, Consumption (g per capita) in Switzerland (2009): 0.096, Consumption (g per capita, approx.) in Germany (2009): 0.12, Excretion rate: 1, Calculated removal (%): 91.9, For induction and maintenance of general anesthesia., Use Classification: Animal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients, Methods of Manufacturing: Trifluoroethanol is methylated with dimethyl sulfate to form the methyl ether, which is then chlorinated to the dichloromethyl ether ... This latter compound, on treatment with HF, SbCl5 forms the product., Isoflurane is prepared by chlorination of 2, 2, 2-trifluoroethoxydifluoromethane, itself obtained by alkylation of trifluoroethanol with difluorochloromethane., Preparation: Croix, Terrell, DE 1814962 (1969), US 3535425 (both to Air Reduction), Formulations, Preparations: FORANE (isoflurane, USP) is also supplied in the, 250 mL, aluminum bottles., FORANE (isoflurane, USP) is packaged in 100 mL and 250 mL amber-colored bottles., Isoflurane USP is packaged in 250mL (NDC 66794-013-25) and 100mL (NDC 66794-013-10) amber-colored bottles., Vet.
Isoflurane is a carbon-based organic compound with CAS registry number 26675-46-7 and molecular formula C3H2ClF5O (molecular weight 184.49), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 26675-46-7
Its molecular formula C3H2ClF5O comprises 3 C, 2 H, 1 Cl, 5 F, 1 O atoms.
Also known as: Isoflurane · 异氟烷
Category: organic chemicals
The CAS registry number of Isoflurane is 26675-46-7.
Molecular formula C3H2ClF5O, molecular weight 184.49.
It is also registered under: Isoflurane, 异氟烷.
Recorded applications: Uses: Used as a special solvent and as an inhalation anesthetic, [Merck Index] A stable, non-explosive inhalation anesthetic, relatively free from significant side effects. [ChemIDplus], Solvent and dispersant for fluorinated materials, MEDICATION, MEDICATION (VET), Use (kg) in Switzerland (2009): >750, Use (kg, approx.) in Germany (2009): >10000, Consumption (g per capita) in Switzerland (2009): 0.096, Consumption (g per capita, approx.) in Germany (2009): 0.12, Excretion rate: 1, Calculated removal (%): 91.9, For induction and maintenance of general anesthesia., Use Classification: Animal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients, Methods of Manufacturing: Trifluoroethanol is methylated with dimethyl sulfate to form the methyl ether, which is then chlorinated to the dichloromethyl ether ... This latter compound, on treatment with HF, SbCl5 forms the product., Isoflurane is prepared by chlorination of 2, 2, 2-trifluoroethoxydifluoromethane, itself obtained by alkylation of trifluoroethanol with difluorochloromethane., Preparation: Croix, Terrell, DE 1814962 (1969), US 3535425 (both to Air Reduction), Formulations, Preparations: FORANE (isoflurane, USP) is also supplied in the, 250 mL, aluminum bottles., FORANE (isoflurane, USP) is packaged in 100 mL and 250 mL amber-colored bottles., Isoflurane USP is packaged in 250mL (NDC 66794-013-25) and 100mL (NDC 66794-013-10) amber-colored bottles., Vet.
Category: Organic Chemicals.
Independent reference data for Isoflurane (CAS 26675-46-7), compiled from public chemistry databases.
| CAS Registry Number | 26675-46-7 |
|---|---|
| PubChem CID | 3763 |
| Molecular formula | C3H2ClF5O |
| IUPAC name | 2-chloro-2-(difluoromethoxy)-1,1,1-trifluoroethane |
| UNII (FDA) | CYS9AKD70P |
| Molecular Weight | 184.49 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 183.9714332 |
| Monoisotopic Mass | 183.9714332 |
| Topological Polar Surface Area | 9.2 |
| Heavy Atom Count | 10 |
| Boiling Point | 48.5 |
|---|---|
| Boiling Point | 48.5 °C |
| Boiling Point | 49 °C |
| Boiling Point | 119.3 °F |
| Melting Point | 48-48.5 |
| Solubility | 4470 |
| Solubility | In water, 4.47X10+3 mg/L at 37 °C |
| Solubility | 3.56e+00 g/L |
| Density | 1.45 |
| Vapor Pressure | 330.0 [mmHg] |
isoflurane; 26675-46-7; 1-Chloro-2,2,2-trifluoroethyl difluoromethyl ether; Forane; 2-Chloro-2-(difluoromethoxy)-1,1,1-trifluoroethane; Forene; Aerrane; Isoflurano; Compound 469; IsoFlo; Isofluranum; Ethane, 2-chloro-2-(difluoromethoxy)-1,1,1-trifluoro-; Terrell; DTXSID3020752; CYS9AKD70P; COMPOUND-469
| GHS notification summary | 2.9% (3 / 103) |
|---|
| GHS notification summary | 2.9% (3 / 103) |
|---|---|
| Reported hazard statements | H336 (93.2%), H373 (40.8%) |
This chemical does not meet GHS hazard criteria for 2.9% (3 of 103) of reports.
H336 (93.2%): May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]
Isoflurane · CAS 26675-46-7 · C3H2ClF5O. UNII CYS9AKD70P. Boiling Point: 48.5; Boiling Point: 48.5 °C; Boiling Point: 49 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 异氟烷