(6Z)-6-[5-(Butylsulfanyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3 -ylidene]-2,4-cyclohexadien-1-one
Names
[ CAS No. ]:
81518-37-8
[ Name ]:
(6Z)-6-[5-(Butylsulfanyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3 -ylidene]-2,4-cyclohexadien-1-one
Chemical & Physical Properties
[ Density]:
1.21g/cm3
[ Boiling Point ]:
465.1ºC at 760 mmHg
[ Molecular Formula ]:
C18H19N3OS
[ Molecular Weight ]:
325.42800
[ Flash Point ]:
235.1ºC
[ Exact Mass ]:
325.12500
[ PSA ]:
75.98000
[ LogP ]:
3.21950
[ Index of Refraction ]:
1.638
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- SK2100000
- CHEMICAL NAME :
- Phenol, 2-(5-(butylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-
- CAS REGISTRY NUMBER :
- 81518-37-8
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C18-H19-N3-O-S
- MOLECULAR WEIGHT :
- 325.46
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 800 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 20,1017,1981