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4989-74-6

4989-74-6结构式
4989-74-6结构式

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英文名 Uric acid, 8-8-butylthio-1,3-dimethyl-2-thio
英文别名 8-Butyltheophylline
Theophylline,8-butyl
8-n-butyl-1,3-dimethylxanthine
8-Butyl-1,3-dimethyl-1,2,3,6-tetrahydro-2,6-dioxopurine
Xanthine,8-butyl-1,3-dimethyl
8-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
8-butyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
8-Butyl-theophyllin
8-Butyl-1,3-dimethyl-3,7-dihydro-purin-2,6-dion
8-n-Butylthio-2-thiotheophyllin
密度 1.39g/cm3
沸点 481ºC at 760 mmHg
分子式 C11H16N4OS2
分子量 284.40100
闪点 244.7ºC
精确质量 284.07700
PSA 113.00000
LogP 2.22180
折射率 1.674

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH5057000
CHEMICAL NAME :
Theophylline, 8-butylthio-2-thio-
CAS REGISTRY NUMBER :
4989-74-6
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H16-N4-O-S2
MOLECULAR WEIGHT :
284.43
WISWESSER LINE NOTATION :
T56 BM DN FNYNVJ CS4 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 :
100 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#04428