4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine,dihydrochloride

名称

[ CAS 号 ]:
21280-17-1

[ 英文名 ]:
4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine,dihydrochloride

物理化学性质

[ 沸点 ]:
460.6ºC at 760 mmHg

[ 分子式 ]:
C16H20Cl2N4O2

[ 分子量 ]:
371.26200

[ 闪点 ]:
232.4ºC

[ 精确质量 ]:
370.09600

[ PSA ]:
50.72000

[ LogP ]:
3.13440

[ 蒸汽压 ]:
1.15E-08mmHg at 25°C

毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV9707000
CHEMICAL NAME :
Pyrimidine, 4-(4-piperonyl-1-piperazinyl)-, dihydrochloride
CAS REGISTRY NUMBER :
21280-17-1
LAST UPDATED :
198201
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H18-N4-O2.2Cl-H
MOLECULAR WEIGHT :
371.30
WISWESSER LINE NOTATION :
T56 BO DO CHJ G1- AT6N DNTJ D- DT6N CNJ &GH 2

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 :
244 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
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