(6Z)-6-[4-(4-bromophenyl)-5-prop-2-enylsulfanyl-2H-1,2,4-triazol-3-yli dene]cyclohexa-2,4-dien-1-one

Names

[ CAS No. ]:
81518-40-3

[ Name ]:
(6Z)-6-[4-(4-bromophenyl)-5-prop-2-enylsulfanyl-2H-1,2,4-triazol-3-yli dene]cyclohexa-2,4-dien-1-one

Chemical & Physical Properties

[ Density]:
1.46g/cm3

[ Boiling Point ]:
494.3ºC at 760 mmHg

[ Molecular Formula ]:
C₁₇H₁₄BrN₃OS

[ Molecular Weight ]:
388.28200

[ Flash Point ]:
252.7ºC

[ Exact Mass ]:
387.00400

[ PSA ]:
75.98000

[ LogP ]:
3.36790

[ Index of Refraction ]:
1.674

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SJ8426000

CHEMICAL NAME :: Phenol, 2-(4-(4-bromophenyl)-5-(2-propenylthio)-4H-1,2,4-tria zol-3-yl)-

CAS REGISTRY NUMBER :: 81518-40-3

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C17-H14-Br-N3-O-S

MOLECULAR WEIGHT :: 388.31

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 :: >1 gm/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

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Related Compounds

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