4-Chloro-2-(tert-butylamino)-6-(4-methylpiperazino)-5-(methylthio)pyrimidine

名称

[ CAS 号 ]:
55477-20-8

[ 英文名 ]:
4-Chloro-2-(tert-butylamino)-6-(4-methylpiperazino)-5-(methylthio)pyrimidine

[英文别名 ]:

物理化学性质

[ 密度 ]:
1.23g/cm3

[ 沸点 ]:
459.5ºC at 760 mmHg

[ 分子式 ]:
C₁₄H₂₄ClN₅S

[ 分子量 ]:
329.89200

[ 闪点 ]:
231.7ºC

[ 精确质量 ]:
329.14400

[ PSA ]:
69.59000

[ LogP ]:
2.89000

[ 折射率 ]:
1.598

[ 储存条件 ]:
库房低温通风干燥

毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UV7910000

CHEMICAL NAME :: Pyrimidine, 4-chloro-2-(tert-butylamino)-6-(4-methylpiperazino)-5 -methylthio-

CAS REGISTRY NUMBER :: 55477-20-8

BEILSTEIN REFERENCE NO. :: 0889233

LAST UPDATED :: 199703

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C14-H24-Cl-N5-S

MOLECULAR WEIGHT :: 329.94

WISWESSER LINE NOTATION :: T6N DNTJ A1 D- DT6N CNJ BMX1&1&1 ES1 FG

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 :: 600 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: 18,553,1975

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 67 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: 18,553,1975