Uric acid, 8-8-butylthio-1,3-dimethyl-2-thio-
Names
[ CAS No. ]:
4989-74-6
[ Name ]:
Uric acid, 8-8-butylthio-1,3-dimethyl-2-thio-
[Synonym ]:
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
Chemical & Physical Properties
[ Density]:
1.39g/cm3
[ Boiling Point ]:
481ºC at 760 mmHg
[ Molecular Formula ]:
C11H16N4OS2
[ Molecular Weight ]:
284.40100
[ Flash Point ]:
244.7ºC
[ Exact Mass ]:
284.07700
[ PSA ]:
113.00000
[ LogP ]:
2.22180
[ Index of Refraction ]:
1.674
Toxicological Information
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