2-[3-chloro-4-(2-methylprop-2-enylamino)phenyl]propanoic acid
Names
[ CAS No. ]:
71589-41-8
[ Name ]:
2-[3-chloro-4-(2-methylprop-2-enylamino)phenyl]propanoic acid
[Synonym ]:
2-(3-Chloro-4-methallylaminophenyl)propionic acid
Propionic acid,2-(3-chloro-4-methallylaminophenyl)
Benzeneacetic acid,3-chloro-a-methyl-4-[(2-methyl-2-propen-1-yl)amino]
Benzeneaceticacid,3-chloro-a-methyl-4-[(2-methyl-2-propenyl)amino]-(9CI)
Chemical & Physical Properties
[ Density]:
1.208g/cm3
[ Boiling Point ]:
392.5ºC at 760 mmHg
[ Molecular Formula ]:
C13H16ClNO2
[ Molecular Weight ]:
253.72500
[ Flash Point ]:
191.2ºC
[ Exact Mass ]:
253.08700
[ PSA ]:
49.33000
[ LogP ]:
3.58910
[ Index of Refraction ]:
1.581
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UE8950000
- CHEMICAL NAME :
- Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-
- CAS REGISTRY NUMBER :
- 71589-41-8
- LAST UPDATED :
- 199109
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C13-H16-Cl-N-O2
- MOLECULAR WEIGHT :
- 253.75
- WISWESSER LINE NOTATION :
- QVY1&R CG DM1Y1&U1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1460 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 14,207,1979