7-ethyl-1,3-dimethyl-6-sulfanylidenepurin-2-one

名称

[ CAS 号 ]:
92985-74-5

[ 英文名 ]:
7-ethyl-1,3-dimethyl-6-sulfanylidenepurin-2-one

[英文别名 ]:

M &M B 6631
Theophylline,7-ethyl-6-thio
7-Ethyl-6-thiotheophylline
B 6631

物理化学性质

[ 分子式 ]:
C₉H₁₂N₄OS

[ 分子量 ]:
224.28300

[ 精确质量 ]:
224.07300

[ PSA ]:
76.84000

[ LogP ]:
0.82290

毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH5621000

CHEMICAL NAME :: Theophylline, 7-ethyl-6-thio-

CAS REGISTRY NUMBER :: 92985-74-5

BEILSTEIN REFERENCE NO. :: 0532656

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H12-N4-O-S

MOLECULAR WEIGHT :: 224.31

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 :: 515 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 17,196,1961

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相关化合物

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