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71589-41-8

71589-41-8 structure
71589-41-8 structure

Name 2-[3-chloro-4-(2-methylprop-2-enylamino)phenyl]propanoic acid
Synonyms 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)
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

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