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Home > Encyclopedia > 4-(3-methoxypropyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione

4-(3-methoxypropyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione

4-(3-methoxypropyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione structure

4-(3-methoxypropyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione 

structure
  • CAS No:

    261965-18-8

  • Formula:

    C13H14F3N3OS

  • Chemical Name:

    4-(3-methoxypropyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione

  • Synonyms:

    4-(3-methoxypropyl)-5-[4-(trifluoromethyl)phenyl]-4H-1,2,4-triazole-3-thiol; 4-(3-methoxypropyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazole-3-thiol;

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

4-(3-methoxypropyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Basic Attributes

317.33000

317.08096774

DTXSID20372493

2933990090

Characteristics

78.74000

3.28910

1.35g/cm3

351ºC

165.5ºC

1.565

4.5E-05mmHg at 25°C

Computed Properties

Molecular Weight:317.33
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:317.08096774
Monoisotopic Mass:317.08096774
Topological Polar Surface Area:69
Heavy Atom Count:21
Complexity:406
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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