2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-(propylthio)-6-thioxo-
Names
[ CAS No. ]:
6493-28-3
[ Name ]:
2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-(propylthio)-6-thioxo-
[Synonym ]:
1,3-dimethyl-8-propylsulfanyl-6-thioxo-1,3,6,7(9)-tetrahydro-purin-2-one
Uric acid,1,3-dimethyl-8-propylthio-6-thio
6-Thio-8-propylthiotheophylline
Theophylline,(8-propylthio)-6-thio
8-n-Propylthio-6-thiotheophyllin
Chemical & Physical Properties
[ Density]:
1.44g/cm3
[ Boiling Point ]:
473.7ºC at 760mmHg
[ Molecular Formula ]:
C10H14N4OS2
[ Molecular Weight ]:
270.37400
[ Exact Mass ]:
270.06100
[ PSA ]:
113.00000
[ LogP ]:
1.83170
[ Index of Refraction ]:
1.693
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XH6493500
- CHEMICAL NAME :
- Theophylline, 8-propylthio-6-thio-
- CAS REGISTRY NUMBER :
- 6493-28-3
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C10-H14-N4-O-S2
- MOLECULAR WEIGHT :
- 270.40
- WISWESSER LINE NOTATION :
- T56 BM DN FNVNYJ CS3 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#04422
Safety Information
[ HS Code ]:
2933990090
Customs
[ HS Code ]: 2933990090
[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%