3,5,5-Trimethylhexanoic acid

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Names

[ CAS No. ]:
3302-10-1

[ Name ]:
3,5,5-Trimethylhexanoic acid

[Synonym ]:
3,5,5-trimethyl-hexanoic acid
EINECS 221-975-0
3,5,5-Trimethyl-hexansaeure
Hexanoic acid, 3,5,5-trimethyl-
3,5,5-trimethyl-n-hexanoic acid
QV1Y1&1X1&1&1
MFCD00020507
Hexanoic acid,3,5,5-trimethyl
iso-octanoic acid
3,5,5-Trimethylhexanoic acid

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
243.3±8.0 °C at 760 mmHg

[ Melting Point ]:
-70°C

[ Molecular Formula ]:
C9H18O2

[ Molecular Weight ]:
158.238

[ Flash Point ]:
109.4±9.8 °C

[ Exact Mass ]:
158.130676

[ PSA ]:
37.30000

[ LogP ]:
2.88

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.438

[ Stability ]:
Stable. Incompatible with reactive metals, strong oxidizing agents.

MSDS

Click to get detail MSDS

Safety Information

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S24/25

[ RIDADR ]:
3265

[ Packaging Group ]:
III

[ Hazard Class ]:
8

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3,5,5-Trimethylhexanal
  • 5,5-dimethyl-3-methylidenehexanoic acid
  • 2,4,4-Trimethylpent-1-ene
  • UNII:O5KUD6I57K
  • 3,5,5-trimethyl-hexane-1,1-dithiol
  • nitric acid
  • 1-hydroxy-3,5,5-trimethyl-hexyl hydroperoxide

DownStream

  • 3,5,5-Trimethylhexanoyl chloride
  • ethyl 3,5,5-trimethyl hexanoate

Related Compounds

  • 3,5,5-Trimethylhexanoic acid
  • methane,3,5,5-trimethylhexanoic acid
  • 3,5,5-Trimethylhexanoic acid,iron salt
  • 3,5,5-Trimethylhexanoic acid,lead salt
  • Perfluoro-3,5,5-trimethylhexanoic acid
  • 3,5,5-Trimethylhexanoic acid,cobalt salt
  • (4,6-Diethoxypyrimidin-5-yl)boronic acid
  • 2-Chloro-6-iodo-3-methoxybenzoic acid
  • (4aS,5aR)-5,5-Difluoro-5a-methyl-1-((2-(trimethylsilyl)ethoxy)methyl)-1,4,4a,5,5a,6-hexahydrocyclopropa[f]indazole-3-carbaldehyde
  • 1-(3-Fluoropyridin-4-yl)cyclobutan-1-amine
  • 2-Cyclobutyltriazol-4-amine;hydrochloride
  • Methyl 3-fluoro-8-iodo-1-naphthoate
  • 2,4-Difluoro-3,5-dimethoxybenzoyl chloride
  • 2,2-Difluoro-2-(3-phenoxyphenyl)ethanol
  • Methyl 4-(bromomethyl)-3-(difluoromethoxy)benzoate
  • (S)-2-(1-(((9H-Fluoren-9-yl)methoxy)carbonyl)azetidin-2-yl)acetic acid
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