3-(3,5-diMethylphenyl)propanoic acid

Modify Date: 2025-09-17 21:49:39

3-(3,5-diMethylphenyl)propanoic acid Structure
3-(3,5-diMethylphenyl)propanoic acid structure
Common Name 3-(3,5-diMethylphenyl)propanoic acid
CAS Number 42287-87-6 Molecular Weight 178.22800
Density 1.074g/cm3 Boiling Point 305.6ºC at 760 mmHg
Molecular Formula C11H14O2 Melting Point N/A
MSDS Chinese USA Flash Point 202.7ºC
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 3-(3,5-diMethylphenyl)propanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.074g/cm3
Boiling Point 305.6ºC at 760 mmHg
Molecular Formula C11H14O2
Molecular Weight 178.22800
Flash Point 202.7ºC
Exact Mass 178.09900
PSA 37.30000
LogP 2.32060
Index of Refraction 1.534
InChIKey CCPNDKXTGJGIIV-UHFFFAOYSA-N
SMILES Cc1cc(C)cc(CCC(=O)O)c1

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319
Precautionary Statements P305 + P351 + P338
RIDADR NONH for all modes of transport
HS Code 2916399090

 Synthetic Route

~94%

3-(3,5-diMethylphenyl)propanoic acid Structure

3-(3,5-diMethyl...

CAS#:42287-87-6

Literature: Orita, Akihiro; Yaruva, Jayamma; Otera, Junzo Angewandte Chemie - International Edition, 1999 , vol. 38, # 15 p. 2267 - 2270

~87%

3-(3,5-diMethylphenyl)propanoic acid Structure

3-(3,5-diMethyl...

CAS#:42287-87-6

Literature: Cheung, Fung K.; Lin, Changxue; Minissi, Franco; Criville, Adriana Lorente; Graham, Mark A.; Fox, David J.; Wills, Martin Organic Letters, 2007 , vol. 9, # 22 p. 4659 - 4662

~%

3-(3,5-diMethylphenyl)propanoic acid Structure

3-(3,5-diMethyl...

CAS#:42287-87-6

Literature: Kadesch Journal of the American Chemical Society, 1944 , vol. 66, p. 1207,1208

~%

3-(3,5-diMethylphenyl)propanoic acid Structure

3-(3,5-diMethyl...

CAS#:42287-87-6

Literature: Kadesch Journal of the American Chemical Society, 1944 , vol. 66, p. 1207,1208

~%

3-(3,5-diMethylphenyl)propanoic acid Structure

3-(3,5-diMethyl...

CAS#:42287-87-6

Literature: Buchner; Schottenhammer Chemische Berichte, 1920 , vol. 53, p. 868

~%

3-(3,5-diMethylphenyl)propanoic acid Structure

3-(3,5-diMethyl...

CAS#:42287-87-6

Literature: Buchner; Schottenhammer Chemische Berichte, 1920 , vol. 53, p. 868

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

3-(3,5-Dimethylphenyl)propanoic acid
3.5-Dimethyl-hydrozimtsaeure
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