Hexyl isobutyrate

Modify Date: 2025-08-25 12:29:23

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

Isobutyric acid structure

Isobutyric acid

CAS#:79-31-2

1-Hexanol structure

1-Hexanol

CAS#:111-27-3

~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%

 Articles1

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Morphology and chemical analysis of the metathoracic scent glands system in Adelphocoris suturalis (Hemiptera: Miridae).

J. Insect Sci. 14 , (2014)

The morphological structure of the metathoracic scent glands (MTGs) in Adelphocoris suturalis was observed by utilizing scanning electron microscope (SEM). Also, the secretions of MTGs in male and fem...

 Synonyms

MFCD00027297
EINECS 219-075-8
hexyl 2-methylpropanoate
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