5-(4-fluorophenyl)-4h-1,2,4-triazole-3-thiol
Names
[ CAS No. ]:
114058-91-2
[ Name ]:
5-(4-fluorophenyl)-4h-1,2,4-triazole-3-thiol
Chemical & Physical Properties
[ Density]:
1.5g/cm3
[ Boiling Point ]:
263.2ºC at 760mmHg
[ Molecular Formula ]:
C8H6FN3S
[ Molecular Weight ]:
195.21700
[ Flash Point ]:
113ºC
[ Exact Mass ]:
195.02700
[ PSA ]:
76.56000
[ LogP ]:
2.27340
[ Vapour Pressure ]:
0.0104mmHg at 25°C
[ Index of Refraction ]:
1.707
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XZ5359088
- CHEMICAL NAME :
- 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(4-fluorophenyl)-
- CAS REGISTRY NUMBER :
- 114058-91-2
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H6-F-N3-S
- MOLECULAR WEIGHT :
- 195.23
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 400 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 31,1253,1988