Hexanoic acid, 2-butyl-

Modify Date: 2024-01-09 19:04:54

Hexanoic acid, 2-butyl- Structure
Hexanoic acid, 2-butyl- structure
 Common Name Hexanoic acid, 2-butyl-
CAS Number 3115-28-4 Molecular Weight 172.26500
Density 0.913g/cm3 Boiling Point 271.6ºC at 760mmHg
Molecular Formula C10H20O2 Melting Point N/A
MSDS N/A Flash Point 142.3ºC

 Names

Name 2-butylhexanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.913g/cm3
Boiling Point 271.6ºC at 760mmHg
Molecular Formula C10H20O2
Molecular Weight 172.26500
Flash Point 142.3ºC
Exact Mass 172.14600
PSA 37.30000
LogP 3.06760
Index of Refraction 1.441

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MO6880000
CHEMICAL NAME :
Hexanoic acid, 2-butyl-
CAS REGISTRY NUMBER :
3115-28-4
BEILSTEIN REFERENCE NO. :
1758237
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H20-O2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
340 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - somnolence (general depressed activity) Behavioral - ataxia
REFERENCE :
NEPHBW Neuropharmacology. (Pergamon Press Ltd., Headington Hill Hall, Oxford OX3 OBW, UK) V.9- 1970- Volume(issue)/page/year: 24,427,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
170 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - somnolence (general depressed activity) Behavioral - ataxia
REFERENCE :
NEPHBW Neuropharmacology. (Pergamon Press Ltd., Headington Hill Hall, Oxford OX3 OBW, UK) V.9- 1970- Volume(issue)/page/year: 24,427,1985

 Safety Information

Hazard Codes Xi
HS Code 2915900090

 Synthetic Route

nonene structure

nonene

CAS#:124-11-8
carbon monoxide structure

carbon monoxide

CAS#:201230-82-2

~%

N/A structure

N/A

CAS#:117214-89-8
2-Propylheptanoic acid structure

2-Propylheptano...

CAS#:31080-39-4
Detail
Literature: Moeller,K.E. Angewandte Chemie, 1963 , vol. 75, p. 1098 - 1101
2-butylhexanenitrile structure

2-butylhexanenitrile

CAS#:4528-41-0

~%

Hexanoic acid, 2-butyl- Structure

Hexanoic acid, ...

CAS#:3115-28-4
Literature: Whitmore; Crooks Journal of the American Chemical Society, 1938 , vol. 60, p. 2078
2-butyl-hexanoic acid ethyl ester structure

2-butyl-hexanoi...

CAS#:2985-48-0

~%

Hexanoic acid, 2-butyl- Structure

Hexanoic acid, ...

CAS#:3115-28-4
Literature: Billon Annales de Chimie (Cachan, France), 1927 , vol. <10>7, p. 362 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1924 , vol. 179, p. 1055
2-butyl-hex-1-en-1-one structure

2-butyl-hex-1-e...

CAS#:36638-69-4

~%

Hexanoic acid, 2-butyl- Structure

Hexanoic acid, ...

CAS#:3115-28-4
Literature: Lyashchuk, S. N.; Skrypnik, Yu. G. Russian Journal of Organic Chemistry, 1994 , vol. 30, # 1.1 p. 10 - 17 Zhurnal Organicheskoi Khimii, 1994 , vol. 30, # 1 p. 12 - 18
5-Decyne structure

5-Decyne

CAS#:1942-46-7

~%

Hexanoic acid, 2-butyl- Structure

Hexanoic acid, ...

CAS#:3115-28-4

Pentanoic acid structure

Pentanoic acid

CAS#:109-52-4
Literature: Franzen Chemische Berichte, 1954 , vol. 87, p. 1219,1223
1-Bromobutane structure

1-Bromobutane

CAS#:109-65-9
1-Hexanoic acid structure

1-Hexanoic acid

CAS#:142-62-1

~%

Hexanoic acid, 2-butyl- Structure

Hexanoic acid, ...

CAS#:3115-28-4
Literature: Pfeffer,P.E. et al. Journal of Organic Chemistry, 1972 , vol. 37, p. 451 - 458

 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-Butyl-hexansaeure
2-Butyl-capronsaeure
2,2-Dibutylacetic acid
Dibutylacetic acid
HEXANOIC ACID,2-BUTYL
2-Butyl hexanoate
Dibutylessigsaeure
2-butyl-hexanoic acid
Di-n-butylacetic acid
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Related Compounds: More...
Hexanoic acid, 2-butyl-2-cyano-, ethyl ester
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Hexanoic acid, 2-butyl-2-ethyl-, methyl ester
106887-88-1
chloromethyl 2-butylhexanoate
89312-21-0
iodomethyl 2-butylhexanoate
89296-57-1
propan-2-yl 2-butylhexanoate
562834-71-3
2-butyl-6-ethoxyhexanoic acid
538374-02-6
methyl 2-butyl-3,5-dioxohexanoate
113618-25-0
2-n-butyl-4-pentenoic acid
1575-75-3
2-Butylcaproic acid methyl ester
24551-95-9
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