5-(4-methoxyphenyl)-2,4-dimethyl-1,2,4-triazole-3-thione

Names

[ CAS No. ]:
110623-39-7

[ Name ]:
5-(4-methoxyphenyl)-2,4-dimethyl-1,2,4-triazole-3-thione

Chemical & Physical Properties

[ Density]:
1.22g/cm3

[ Boiling Point ]:
314.7ºC at 760mmHg

[ Molecular Formula ]:
C11H13N3OS

[ Molecular Weight ]:
235.30500

[ Flash Point ]:
144.1ºC

[ Exact Mass ]:
235.07800

[ PSA ]:
64.07000

[ LogP ]:
2.16370

[ Vapour Pressure ]:
0.000457mmHg at 25°C

[ Index of Refraction ]:
1.619

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5359080
CHEMICAL NAME :
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-2,4-dimethyl-5-(4-methoxyphenyl)-
CAS REGISTRY NUMBER :
110623-39-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H13-N3-O-S
MOLECULAR WEIGHT :
235.33

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 :
>800 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

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 2-{2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)acetamido]acetyl}-2-azabicyclo[4.1.0]heptane-1-carboxylic acid
  • Methyl(2-{pyrazolo[1,5-a]pyrimidin-6-yl}propan-2-yl)amine
  • 2,2-difluoro-2-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol
  • rac-2-[(1R,3S)-3-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclopentaneamido]cyclopentyl]acetic acid
  • rac-3-{2-[(1R,3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclopentyl]acetyl}-1,3-thiazolidine-4-carboxylic acid
  • (3RS,4RS)-1-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
  • rac-(1R,6S)-2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4,4-difluorobutanoyl]-2-azabicyclo[4.1.0]heptane-1-carboxylic acid
  • 1-[3-bromo-5-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)benzoyl]-3-methylazetidine-3-carboxylic acid
  • 2-{1-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(propan-2-yl)butanamido]cyclopropyl}acetic acid
  • 4-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(propan-2-yl)butanamido]butanoic acid
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