3,5,5-Trimethylhexanoic acid

Modify Date: 2024-01-02 15:00:20

3,5,5-Trimethylhexanoic acid Structure
3,5,5-Trimethylhexanoic acid structure
Common Name 3,5,5-Trimethylhexanoic acid
CAS Number 3302-10-1 Molecular Weight 158.238
Density 0.9±0.1 g/cm3 Boiling Point 243.3±8.0 °C at 760 mmHg
Molecular Formula C9H18O2 Melting Point -70°C
MSDS N/A Flash Point 109.4±9.8 °C

 Names

Name 3,5,5-Trimethylhexanoic acid
Synonym More Synonyms

 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.

 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

~99%

3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: Celanese Chemicals Europe GmbH Patent: EP1657230 A1, 2006 ; Location in patent: Page/Page column 10-11 ;

~4%

3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: Angewandte Chemie - International Edition, , vol. 46, # 27 p. 5202 - 5205

~%

3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: Justus Liebigs Annalen der Chemie, , vol. 661, p. 111 - 157

~%

3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: Justus Liebigs Annalen der Chemie, , vol. 661, p. 111 - 157

~%

3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: Justus Liebigs Annalen der Chemie, , vol. 661, p. 111 - 157

~%

3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: Journal of the Chemical Society, , p. 2543

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3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: Journal of the American Chemical Society, , vol. 74, p. 3982

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3,5,5-Trimethylhexanoic acid Structure

3,5,5-Trimethyl...

CAS#:3302-10-1

Literature: US2568682 , ;

 Synonyms

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