2-(2-dimethylaminoethyl)-5-methyl-2-naphthalen-2-yl-hex-4-enenitrile

Modify Date: 2023-10-17 11:54:27

2-(2-dimethylaminoethyl)-5-methyl-2-naphthalen-2-yl-hex-4-enenitrile Structure
2-(2-dimethylaminoethyl)-5-methyl-2-naphthalen-2-yl-hex-4-enenitrile structure
 Common Name 2-(2-dimethylaminoethyl)-5-methyl-2-naphthalen-2-yl-hex-4-enenitrile
CAS Number 50765-85-0 Molecular Weight 342.90500
Density 1.022g/cm3 Boiling Point 471.3ºC at 760 mmHg
Molecular Formula C21H27ClN2 Melting Point N/A
MSDS N/A Flash Point 198.8ºC

 Names

Name (3-cyano-6-methyl-3-naphthalen-2-ylhept-5-enyl)-dimethylazanium,chloride

 Chemical & Physical Properties

Density 1.022g/cm3
Boiling Point 471.3ºC at 760 mmHg
Molecular Formula C21H27ClN2
Molecular Weight 342.90500
Flash Point 198.8ºC
Exact Mass 342.18600
PSA 27.03000
LogP 5.71118
Index of Refraction 1.57

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QJ1385000
CHEMICAL NAME :
2-Naphthaleneacetonitrile, alpha-(2-dimethylaminoethyl)-alpha-(3-methyl-2-buteny l)-, hydrochloride
CAS REGISTRY NUMBER :
50765-85-0
LAST UPDATED :
199109
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C21-H26-N2.Cl-H
MOLECULAR WEIGHT :
342.95
WISWESSER LINE NOTATION :
L66J CXCN&2N1&1&2UY1&1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>800 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: 16,720,1973
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
188 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: 16,720,1973
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Chemsrc provides CAS#:50765-85-0 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-(2-dimethylaminoethyl)-5-methyl-2-naphthalen-2-yl-hex-4-enenitrile>> amp version: 2-(2-dimethylaminoethyl)-5-methyl-2-naphthalen-2-yl-hex-4-enenitrile

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