6-((o-Fluorobenzyl)thio)purine
Names
[ CAS No. ]:
3798-86-5
[ Name ]:
6-((o-Fluorobenzyl)thio)purine
[Synonym ]:
6-(2-fluoro-benzylmercapto)-7(9)H-purine
Purine,6-((o-fluorobenzyl)thio)
6-(2-Fluor-benzylmercapto)-7(9)H-purin
1H-Purine,6-(((2-fluorophenyl)methyl)thio)
6-((o-Fluorobenzyl)thio)purine
Chemical & Physical Properties
[ Density]:
1.47g/cm3
[ Boiling Point ]:
399.6ºC at 760 mmHg
[ Molecular Formula ]:
C12H9FN4S
[ Molecular Weight ]:
260.29000
[ Flash Point ]:
195.5ºC
[ Exact Mass ]:
260.05300
[ PSA ]:
79.76000
[ LogP ]:
2.78430
[ Index of Refraction ]:
1.725
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UO8541000
- CHEMICAL NAME :
- Purine, 6-((o-fluorobenzyl)thio)-
- CAS REGISTRY NUMBER :
- 3798-86-5
- BEILSTEIN REFERENCE NO. :
- 0026523
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C12-H9-F-N4-S
- MOLECULAR WEIGHT :
- 260.31
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Parenteral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 127 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 71,618,1982
Safety Information
[ HS Code ]:
2933990090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
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%