Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester

Modify Date: 2024-01-08 09:32:00

Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester Structure
Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester structure
Common Name Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester
CAS Number 36679-74-0 Molecular Weight 200.31800
Density 0.867g/cm3 Boiling Point 202.4ºC at 760mmHg
Molecular Formula C12H24O2 Melting Point N/A
MSDS N/A Flash Point 78.8ºC

 Names

Name 2,2,4-trimethylpentylmonoisobutyrate
Synonym More Synonyms

 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

~%

Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester Structure

Propanoic acid,...

CAS#:36679-74-0

Literature: Schwenk,U.; Becker,A. Justus Liebigs Annalen der Chemie, 1972 , vol. 756, p. 162 - 169

~%

Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester Structure

Propanoic acid,...

CAS#:36679-74-0

Literature: Schwenk,U.; Becker,A. Justus Liebigs Annalen der Chemie, 1972 , vol. 756, p. 162 - 169

~%

Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester Structure

Propanoic acid,...

CAS#:36679-74-0

Literature: Schwenk,U.; Becker,A. Justus Liebigs Annalen der Chemie, 1972 , vol. 756, p. 162 - 169

~%

Propanoic acid,2-methyl-, 2,2,4-trimethylpentyl ester Structure

Propanoic acid,...

CAS#:36679-74-0

Literature: Terentjew Bulletin de la Societe Chimique de France, 1925 , vol. <4>37, p. 1555

 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%

 Synonyms

2,2,4-trimethylpentyl isobutyrate