n-Caproic acid n-butyl ester

Modify Date: 2024-01-02 13:11:56

n-Caproic acid n-butyl ester Structure
n-Caproic acid n-butyl ester structure
Common Name n-Caproic acid n-butyl ester
CAS Number 626-82-4 Molecular Weight 172.26500
Density 0.866 Boiling Point 61-62 °C (3 mmHg)
Molecular Formula C10H20O2 Melting Point N/A
MSDS Chinese USA Flash Point 178 ºF

 Names

Name Butyl Hexanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.866
Boiling Point 61-62 °C (3 mmHg)
Molecular Formula C10H20O2
Molecular Weight 172.26500
Flash Point 178 ºF
Exact Mass 172.14600
PSA 26.30000
LogP 2.91000
Index of Refraction 1.416

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MO6950000
CHEMICAL NAME :
Hexanoic acid, butyl ester
CAS REGISTRY NUMBER :
626-82-4
BEILSTEIN REFERENCE NO. :
1754426
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C10-H20-O2
MOLECULAR WEIGHT :
172.30

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 21,653,1983 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 21,653,1983
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 :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 21,653,1983

 Safety Information

Hazard Codes Xi
RIDADR NONH for all modes of transport
RTECS MO6950000

 Synthetic Route

 Articles3

More Articles
Ester synthesis catalyzed by Mucor miehei lipase immobilized on magnetic polysiloxane-polyvinyl alcohol particles.

Appl. Biochem. Biotechnol. 113 , 189-99, (2004)

Mucor miehei lipase was immobilized on magnetic polysiloxane-polyvinyl alcohol particles by covalent binding with high activity recovered. The performance of the resulting immobilized biocatalyst was ...

Ester-exchange catalyzed by lipase modified with polyethylene glycol.

Biochem. Biophys. Res. Commun. 131(2) , 532-6, (1985)

Lipoprotein lipase was modified with 2,4-bis(O-methoxypolyethylene glycol)-6-chloro-s-triazine; forty-six percent out of seven amino groups in the molecule were substituted. The modified lipase cataly...

Enzymatic reactions and synthesis of n-butyl caproate: esterification, transesterification and aminolysis using a recombinant lipase from Geobacillus thermoleovorans CCR11.

Environ. Technol. 31(10) , 1101-6, (2010)

The recombinant lipase LipMatCCR11 from the thermophilic strain Geobacillus thermoleovorans CCR11 was applied in the synthesis of n-butyl caproate via transesterification in hexane and xylene. The sho...

 Synonyms

MFCD00053804
Butyl hexanoate
EINECS 210-964-6