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4791-38-2

4791-38-2结构式
4791-38-2结构式

化源商城直购

英文名 8-hexylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
英文别名 8-n-Hexylthio-6-thiotheophyllin
Uric acid,1,3-dimethyl-8-hexylthio-6-thio
密度 1.32g/cm3
沸点 497.9ºC at 760 mmHg
分子式 C13H20N4OS2
分子量 312.45400
闪点 254.9ºC
精确质量 312.10800
PSA 113.00000
LogP 3.00200
折射率 1.646

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH5720000
CHEMICAL NAME :
Theophylline, 8-hexylthio-6-thio-
CAS REGISTRY NUMBER :
4791-38-2
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H20-N4-O-S2
MOLECULAR WEIGHT :
312.49
WISWESSER LINE NOTATION :
T56 BM DN FNVNYJ CS6 F1 H1 IUS

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#04426