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2-(Hexahydro-4-piperonyl-1H-1,4-diazepin-1-yl)pyrimidine

Names

[ CAS No. ]:
21280-10-4

[ Name ]:
2-(Hexahydro-4-piperonyl-1H-1,4-diazepin-1-yl)pyrimidine

Chemical & Physical Properties

[ Density]:
1.267g/cm3

[ Boiling Point ]:
481.1ºC at 760 mmHg

[ Molecular Formula ]:
C17H20N4O2

[ Molecular Weight ]:
312.36600

[ Flash Point ]:
244.8ºC

[ Exact Mass ]:
312.15900

[ PSA ]:
50.72000

[ LogP ]:
1.92050

[ Vapour Pressure ]:
2.04E-09mmHg at 25°C

[ Index of Refraction ]:
1.616

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV9276500
CHEMICAL NAME :
Pyrimidine, 2-(hexahydro-4-piperonyl-1H-1,4-diazepin-1-yl)-
CAS REGISTRY NUMBER :
21280-10-4
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H20-N4-O2
MOLECULAR WEIGHT :
312.41
WISWESSER LINE NOTATION :
T56 BO DO CHJ G1- AT7N DNTJ D- BT6N CNJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
300 mg/kg
TOXIC EFFECTS :
Vascular - regional or general arteriolar or venous dilation
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: 11,1151,1968

Related Compounds

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