4-Methylhexanoic acid

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Names

[ CAS No. ]:
1561-11-1

[ Name ]:
4-Methylhexanoic acid

[Synonym ]:
4-METHYLCAPROIC ACID
EINECS 216-336-8
4-methylhexanoicacid
4-Methylhexansure
Hexanoic acid,4-methyl
4-methyl-hexanoicaci
MFCD00870848
4-ETHYLPENTANOIC ACID
Hexanoic acid, 4-methyl-

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
215.3±8.0 °C at 760 mmHg

[ Molecular Formula ]:
C7H14O2

[ Molecular Weight ]:
130.185

[ Flash Point ]:
102.8±6.9 °C

[ Exact Mass ]:
130.099380

[ PSA ]:
37.30000

[ LogP ]:
2.19

[ Vapour Pressure ]:
0.1±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.431

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS02, GHS05

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H226-H314

[ Precautionary Statements ]:
P280-P305 + P351 + P338-P310

[ Personal Protective Equipment ]:
Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
C: Corrosive;

[ Risk Phrases ]:
10-34

[ Safety Phrases ]:
26-36/37/39-45

[ RIDADR ]:
UN 2920 8/PG 2

[ HS Code ]:
2915900090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • (1-methyl-propylidene)-succinic acid
  • Citronellal
  • 4-METHYL-1-HEXANOL
  • (4S)-4-Methyl-1-hexanol
  • 4-methyl-1-(phenylsulfinyl)hexan-2-one
  • 2-Octanone, 3-(hydroxymethyl)-6-methyl
  • 2,6-Dimethyl-2-octene
  • 5-methyl-2-prop-1-en-2-ylheptan-1-ol
  • 2-Chlorobutane
  • Carbon dioxide

DownStream

  • ethyl 4-methylhexanoate
  • (4S)-4-Methyl-1-hexanol
  • 4-METHYL-1-HEXANOL

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%

Articles

Novel glycine conjugates in medium-chain acyl-CoA dehydrogenase deficiency.

J. Inherit. Metab. Dis. 16(2) , 392-8, (1993)

The glycine conjugates of isocaproic, 4-methylhexanoic, 7-hydroxyoctanoic and 8-hydroxyoctanoic acids have been identified in the urine of children with medium-chain acyl-CoA dehydrogenase (MCAD) defi...

Enantioselective analysis of methyl-branched alcohols and acids in rhubarb (Rheum rhabarbarum L.) stalks.

J. Agric. Food Chem. 51(24) , 7086-91, (2003)

The enantiomeric compositions of 2-methylbutanol (1), 4-methylhexanol (2), 2-methylbutanoic acid (3), and 4-methylhexanoic acid (4) present in rhubarb (Rheum rhabarbarum L.) stalks were determined. En...


More Articles

Related Compounds

  • 4-Methylhexanoic acid
  • (4S)-4-methylhexanoic acid
  • (4R)-4-methylhexanoic acid
  • 2-amino-4-methylhexanoic acid
  • 3-amino-4-methylhexanoic acid
  • 3-Amino-4-methylhexanoic acid
  • 1-(Propylsulfonyl)pyrrolidin-3-amine hydrochloride
  • 2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[1,5-a]pyridine
  • 3-(((Piperidin-4-ylmethyl)amino)methyl)benzonitrile hydrochloride
  • (E)-tert-butyl 3-(3-methoxy-3-oxoprop-1-en-1-yl)piperidine-1-carboxylate
  • [4-(2-nitrophenyl)tetrahydrofuran-2-yl]methanamine
  • 4-chloro-6-cyclopropyl-thieno[3,2-d]pyrimidine
  • 2-propylhept-6-en-1-ol
  • 4-Chloro-2-oxo-3(2H)-benzothiazoleacetamide
  • 4-Phenyl-5-(phenylthio)-2-thiazolamine
  • 2',3'-Dihydrospiro[cyclopentane-1,1'-isoindole]
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