3-[(2-methoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Names

[ CAS No. ]:
107952-04-5

[ Name ]:
3-[(2-methoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Chemical & Physical Properties

[ Density]:
1.27g/cm3

[ Boiling Point ]:
435.1ºC at 760 mmHg

[ Molecular Formula ]:
C16H15N3O2S

[ Molecular Weight ]:
313.37400

[ Flash Point ]:
216.9ºC

[ Exact Mass ]:
313.08800

[ PSA ]:
87.97000

[ LogP ]:
3.14360

[ Vapour Pressure ]:
8.99E-08mmHg at 25°C

[ Index of Refraction ]:
1.64

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5359105
CHEMICAL NAME :
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-((2-methoxyphenoxy)methyl)-4-phenyl-
CAS REGISTRY NUMBER :
107952-04-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H15-N3-O2-S
MOLECULAR WEIGHT :
313.40

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 :
>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: 26,251,1987

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 1-(3,4-Dihydroxy-5-methoxyphenyl)-2,2-difluoroethan-1-one
  • 2-(3-{[(Tert-butoxy)carbonyl](methyl)amino}-2-methyl-5-(piperazin-1-yl)phenyl)acetic acid
  • Tert-butyl 4-[3-azido-4-methyl-5-(sulfanylmethyl)phenyl]piperazine-1-carboxylate
  • 3-[3-(1H-indol-3-yl)propyl]pyrrolidin-3-ol
  • tert-butyl N-[2-amino-2-(1-methyl-1H-1,3-benzodiazol-5-yl)ethyl]carbamate
  • Methyl 3-(4-cyanothiophen-2-yl)-3-hydroxypropanoate
  • (2R)-4,4,5,5,6,6,6-heptafluorohexan-2-ol
  • 4-Hydroxy-1-(6-methylpyridin-3-yl)cyclohexane-1-carboxylic acid
  • 4-Ethoxy-3-methoxybenzene-1-sulfonamide
  • 3-{4-[(Tert-butoxy)carbonyl]piperazin-1-yl}-4-methyl-5-(sulfanylmethyl)benzoic acid
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