Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester
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Names
[ CAS No. ]:
36679-74-0
[ Name ]:
Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester
[Synonym ]:
2,2,4-trimethylpentyl isobutyrate
Chemical & Physical Properties
[ Density]:
0.867g/cm3
[ Boiling Point ]:
202.4ºC at 760mmHg
[ Molecular Formula ]:
C12H24O2
[ Molecular Weight ]:
200.31800
[ Flash Point ]:
78.8ºC
[ Exact Mass ]:
200.17800
[ PSA ]:
26.30000
[ LogP ]:
3.25790
[ Index of Refraction ]:
1.427
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UA2482000
- CHEMICAL NAME :
- Propanoic acid, 2-methyl-, 2,2,4-trimethylpentyl ester
- CAS REGISTRY NUMBER :
- 36679-74-0
- BEILSTEIN REFERENCE NO. :
- 1765518
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C12-H24-O2
- MOLECULAR WEIGHT :
- 200.36
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 1,193,1992
- TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration into the eye
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 1,193,1992 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 7500 uL/kg
- TOXIC EFFECTS :
- Sense Organs and Special Senses (Eye) - effect, not otherwise specified Behavioral - ataxia Gastrointestinal - changes in structure or function of salivary glands
- REFERENCE :
- ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 1,193,1992
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >16 mL/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity)
- REFERENCE :
- ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 1,193,1992
Safety Information
[ 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%