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40119-27-5

40119-27-5 structure
40119-27-5 structure

Name 1-(4-aminophenyl)-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-3-one
Synonyms 1-(4'-aminophenyl)-1,4-dihydro-4-isopropyl-3(2H)-isoquinolinone
3(2H)-Isoquinolinone,1,4-dihydro-1-(4-aminophenyl)-4-(1-methylethyl)
1-(4-amino-phenyl)-4-isopropyl-1,4-dihydro-2H-isoquinolin-3-one
1,4-Dihydro-1-(4-aminophenyl)-4-(1-methylethyl)-3(2H)-isoquinolinone
Density 1.133g/cm3
Boiling Point 515.8ºC at 760 mmHg
Molecular Formula C18H20N2O
Molecular Weight 280.36400
Flash Point 265.7ºC
Exact Mass 280.15800
PSA 55.12000
LogP 4.13760
Index of Refraction 1.598

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NX6036585
CHEMICAL NAME :
3(2H)-Isoquinolinone, 1,4-dihydro-1-(4-aminophenyl)-4-(1-methylethyl)-
CAS REGISTRY NUMBER :
40119-27-5
BEILSTEIN REFERENCE NO. :
0420003
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H20-N2-O
MOLECULAR WEIGHT :
280.40

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 :
>1600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 20,1384,1977