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4869-70-9

4869-70-9结构式

常用中文名：Theophylline, 8-pentylthio-2-thio-
常用英文名：Theophylline, 8-pentylthio-2-thio-
CAS号：4869-70-9
分子式：C₁₂H₁₈N₄OS₂
分子量：298.42800
发布时间：2016-05-16 22:01:32
更新时间：2024-03-04 19:08:50

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英文名	1,3-dimethyl-8-pentylsulfanyl-2-sulfanylidene-7H-purin-6-one
英文别名	8-n-Pentylthio-2-thiotheophyllin Theophylline,8-pentylthio-2-thio Uric acid,1,3-dimethyl-8-pentylthio-2-thio

密度	1.35g/cm3
沸点	489.1ºC at 760 mmHg
分子式	C₁₂H₁₈N₄OS₂
分子量	298.42800
闪点	249.6ºC
精确质量	298.09200
PSA	113.00000
LogP	2.61190
折射率	1.659

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH6486500

CHEMICAL NAME :: Theophylline, 8-pentylthio-2-thio-

CAS REGISTRY NUMBER :: 4869-70-9

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H18-N4-O-S2

MOLECULAR WEIGHT :: 298.46

WISWESSER LINE NOTATION :: T56 BM DN FNYNVJ CS5 F1 GUS H1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 56 mg/kg

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

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04432