Hexanoic acid,2-ethyl-, ethenyl ester
Names
[ CAS No. ]:
94-04-2
[ Name ]:
Hexanoic acid,2-ethyl-, ethenyl ester
[Synonym ]:
EINECS 202-297-4
ethenyl 2-ethylhexanoate
Chemical & Physical Properties
[ Density]:
0.87 g/cm3
[ Boiling Point ]:
86ºC 30mm
[ Melting Point ]:
-90ºC(lit.)
[ Molecular Formula ]:
C10H18O2
[ Molecular Weight ]:
170.24900
[ Flash Point ]:
65ºC
[ Exact Mass ]:
170.13100
[ PSA ]:
26.30000
[ LogP ]:
2.88950
[ Index of Refraction ]:
n20/D 1.426(lit.)
[ Stability ]:
Stable. Incompatible with strong oxidizing agents, strong acids, strong bases.
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- MO7875000
- CHEMICAL NAME :
- Hexanoic acid, 2-ethyl-, vinyl ester
- CAS REGISTRY NUMBER :
- 94-04-2
- BEILSTEIN REFERENCE NO. :
- 1767220
- LAST UPDATED :
- 199806
- DATA ITEMS CITED :
- 6
- MOLECULAR FORMULA :
- C10-H18-O2
- MOLECULAR WEIGHT :
- 170.28
- WISWESSER LINE NOTATION :
- 4Y2&VO1U1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- Open irritation test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4290 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 10 mL/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA
- TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Human Lymphocyte
- DOSE/DURATION :
- 1 mmol/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 279,75,1992
Safety Information
[ Hazard Codes ]:
Xi
[ Risk Phrases ]:
36/37/38
[ Safety Phrases ]:
26-36/37/39-36-61-60-36/37
[ RIDADR ]:
UN 3082
[ RTECS ]:
MO7875000
[ Packaging Group ]:
III
[ Hazard Class ]:
9
[ HS Code ]:
2915900090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2915900090
[ Summary ]:
2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%