2-((4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl)amino)ethanethiol, hydro gen sulfate (ester)

名称

[ CAS 号 ]:
38920-53-5

[ 英文名 ]:
2-((4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl)amino)ethanethiol, hydro gen sulfate (ester)

物理化学性质

[ 密度 ]:
1.55g/cm3

[ 分子式 ]:
C₁₃H₂₁N₅O₅S₂

[ 分子量 ]:
391.46600

[ 精确质量 ]:
391.09800

[ PSA ]:
161.90000

[ LogP ]:
0.81120

[ 折射率 ]:
1.68

毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KJ1053000

CHEMICAL NAME :: Ethanethiol, 2-((4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butyl)amino)- , hydrogen sulfate (ester)

CAS REGISTRY NUMBER :: 38920-53-5

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H21-N5-O5-S2

MOLECULAR WEIGHT :: 391.51

WISWESSER LINE NOTATION :: T56 BN DN FNVNVJ B4M2SSWQ F1 H1

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 :: 100 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: 15,968,1972

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相关化合物

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