Hexyl isobutyrate

Modify Date: 2024-01-14 18:11:59

Hexyl isobutyrate Structure
Hexyl isobutyrate structure
Common Name Hexyl isobutyrate
CAS Number 2349-07-7 Molecular Weight 172.26500
Density 0.86 Boiling Point 199ºC
Molecular Formula C10H20O2 Melting Point N/A
MSDS Chinese USA Flash Point 164 °F

 Names

Name Hexyl-2-methylpropionate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.86
Boiling Point 199ºC
Molecular Formula C10H20O2
Molecular Weight 172.26500
Flash Point 164 °F
Exact Mass 172.14600
PSA 26.30000
LogP 2.76590
Vapour Pressure 0.413mmHg at 25°C
Index of Refraction 1.413

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NQ4695000
CHEMICAL NAME :
Isobutyric acid, hexyl ester
CAS REGISTRY NUMBER :
2349-07-7
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: 20,719,1982 ** 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: 20,719,1982
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: 20,719,1982

 Safety Information

Personal Protective Equipment Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
WGK Germany 2
RTECS NQ4695000
HS Code 2915900090

 Synthetic Route

~99%

Hexyl isobutyrate Structure

Hexyl isobutyrate

CAS#:2349-07-7

Literature: Divakar, Soundar Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2002 , vol. 41, # 9 p. 1919 - 1922

 Precursor & DownStream

Precursor  2

DownStream  0

 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%

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 Synonyms

MFCD00027297
EINECS 219-075-8
hexyl 2-methylpropanoate