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59177-67-2

59177-67-2 structure
59177-67-2 structure

Name 1-[(2-bromo-1-adamantyl)methyl]-4-methylpiperazine,dihydrobromide
Boiling Point 384.5ºC at 760 mmHg
Molecular Formula C16H29Br3N2
Molecular Weight 489.12700
Flash Point 186.4ºC
Exact Mass 485.98800
PSA 6.48000
LogP 4.61560

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AU4447000
CHEMICAL NAME :
Adamantane, 2-bromo-1-(4-methyl-1-piperazinyl)methyl-, dihydrobromide
CAS REGISTRY NUMBER :
59177-67-2
LAST UPDATED :
199007
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C16-H27-Br-N2.2Br-H
MOLECULAR WEIGHT :
489.20
WISWESSER LINE NOTATION :
L66 B6/B-H/DI A B- C 1B ITJ CE B1- AT6N DNTJ D1 &EH 2

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 :
586 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: 19,967,1976
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
293 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: 19,967,1976