-
Name
3,5,5-TRIMETHYLHEXYL ACETATE
- EINECS 261-245-9
- CAS No. 58430-94-7
- Density 0,87 g/cm3
- Solubility insoluble in water, soluble in organic solvents
- Melting Point -26°C (estimate)
- Formula C11H22 O2
- Boiling Point 193.2 °C at 760 mmHg
- Molecular Weight 186.294
- Flash Point 79°C
- Transport Information
- Appearance clear colourless liquid
- Safety Mildly toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 1-Hexanol,3,5,5-trimethyl-, acetate (9CI); 3,5,5-Trimethylhexyl acetate; Vanoris
- PSA 26.30000
- LogP 3.01190
3,5,5-Trimethylhexyl Acetate Chemical Properties
Chemistry informtion about 3,5,5-Trimethylhexyl Acetate (CAS NO.58430-94-7) is:
IUPAC Name: 3,5,5-Trimethylhexyl Acetate
Synonyms: Nonisyl Acetate ; 1-Hexanol,3,5,5-Trimethyl-,Acetate ; 3,5,5-Trimethyl-1-Hexanoacetate ; 3,5,5-Trimethylhexan-1-Olacetate ; Aceticacidtrimethylester ; Vanoris ; Acetic Acid 3,5,5-Trimethylhexyl Ester ; 3,5,5-Trimethyl-1-Hexanol Acetate
MF: C11H22O2
MW: 186.29
EINECS: 261-245-9
Density: 0.872 g/cm3
Flash Point: 91.3 °C
Boiling Point: 210 °C at 760 mmHg
Vapour Pressure: 0.197 mmHg at 25°C
Enthalpy of Vaporization: 44.63 kJ/mol
Following is the molecular structure of 3,5,5-Trimethylhexyl Acetate (CAS NO.58430-94-7) is:
3,5,5-Trimethylhexyl Acetate Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rabbit | LD50 | skin | > 5gm/kg (5000mg/kg) | Food and Cosmetics Toxicology. Vol. 12, Pg. 1009, 1974. | |
| rat | LD50 | oral | 4250mg/kg (4250mg/kg) | Food and Cosmetics Toxicology. Vol. 12, Pg. 1009, 1974. |
3,5,5-Trimethylhexyl Acetate Consensus Reports
Reported in EPA TSCA Inventory.
3,5,5-Trimethylhexyl Acetate Safety Profile
Mildly toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.
RTECS: AK0840000
3,5,5-Trimethylhexyl Acetate Specification
3,5,5-Trimethylhexyl Acetate (CAS NO.58430-94-7) is a colourless liquid with a floral, fruity odour.
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