1-Hexanol,3,5,5-trimethyl-, 1-acetate
Names
[ CAS No. ]:
58430-94-7
[ Name ]:
1-Hexanol,3,5,5-trimethyl-, 1-acetate
[Synonym ]:
3,5,5-trimethyl-1-hexanol acetate
EINECS 261-245-9
3,5,5-Trimethylhexan-1-ol acetate
ACETIC ACID,3,5,5-TRIMETHYLHEXYL ESTER
1-Hexanol,3,5,5-trimethyl-,acetate
iso-nonyl acetate
Nonanyl acetate
Chemical & Physical Properties
[ Density]:
0.87 g/cm3
[ Boiling Point ]:
193.2ºC at 760 mmHg
[ Melting Point ]:
-26°C (estimate)
[ Molecular Formula ]:
C11H22O2
[ Molecular Weight ]:
186.29100
[ Flash Point ]:
79ºC
[ Exact Mass ]:
186.16200
[ PSA ]:
26.30000
[ LogP ]:
3.01190
[ Index of Refraction ]:
1.424
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AK0840000
- CHEMICAL NAME :
- Acetic acid, 3,5,5-trimethylhexyl ester
- CAS REGISTRY NUMBER :
- 58430-94-7
- BEILSTEIN REFERENCE NO. :
- 1758391
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C11-H22-O2
- MOLECULAR WEIGHT :
- 186.33
- WISWESSER LINE NOTATION :
- 1X1&1&1Y1&2OV1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4250 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,1009,1974
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,1009,1974
Safety Information
[ RTECS ]:
AK0840000