trans-3-(2'-methylphenyl)-2-propene-1-carboxamide

Modify Date: 2025-08-25 19:15:07

trans-3-(2'-methylphenyl)-2-propene-1-carboxamide Structure
trans-3-(2'-methylphenyl)-2-propene-1-carboxamide structure
Common Name trans-3-(2'-methylphenyl)-2-propene-1-carboxamide
CAS Number 146669-23-0 Molecular Weight 161.20000
Density 1.093g/cm3 Boiling Point 354.4ºC at 760mmHg
Molecular Formula C10H11NO Melting Point N/A
MSDS N/A Flash Point 168.1ºC

 Names

Name (E)-3-(2-methylphenyl)prop-2-enamide

 Chemical & Physical Properties

Density 1.093g/cm3
Boiling Point 354.4ºC at 760mmHg
Molecular Formula C10H11NO
Molecular Weight 161.20000
Flash Point 168.1ºC
Exact Mass 161.08400
PSA 44.08000
LogP 2.64320
Vapour Pressure 3.36E-05mmHg at 25°C
Index of Refraction 1.601
InChIKey GLJWZMYXVRYLPB-VOTSOKGWSA-N
SMILES Cc1ccccc1C=CC(N)=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UC6475680
CHEMICAL NAME :
2-Propenamide, 3-(2-methylphenyl)-, (E)-
CAS REGISTRY NUMBER :
146669-23-0
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H11-N-O
MOLECULAR WEIGHT :
161.22

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>400 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - antipsychotic
REFERENCE :
JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 45,1827,1992

 Synthetic Route

~78%

trans-3-(2'-methylphenyl)-2-propene-1-carboxamide Structure

trans-3-(2'-met...

CAS#:146669-23-0

Literature: Penafiel, Itziar; Pastor, Isidro M.; Yus, Miguel European Journal of Organic Chemistry, 2012 , # 16 p. 3151 - 3156

~43%

trans-3-(2'-methylphenyl)-2-propene-1-carboxamide Structure

trans-3-(2'-met...

CAS#:146669-23-0

Literature: An, Guanghui; Ji, Xiaoyun; Han, Jianlin; Pan, Yi Synthetic Communications, 2011 , vol. 41, # 10 p. 1464 - 1471
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