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Home > Encyclopedia > 1-benzyl-3-nitro-1H-1,2,4-triazole

1-benzyl-3-nitro-1H-1,2,4-triazole

1-benzyl-3-nitro-1H-1,2,4-triazole structure

1-benzyl-3-nitro-1H-1,2,4-triazole 

structure
  • CAS No:

    136118-54-2

  • Formula:

    C9H8N4O2

  • Chemical Name:

    1-benzyl-3-nitro-1H-1,2,4-triazole

  • Synonyms:

    1-benzyl-3-nitro-1H-1,2,4-triazole;136118-54-2;3-nitro-1-benzyl-1,2,4-triazole;ZINC484238;SBB073423;STL405585;AKOS003245438;MCULE-2129871777;ST45055118;AK-968/14004674

1-benzyl-3-nitro-1H-1,2,4-triazole Basic Attributes

204.18542

204.065

Characteristics

76.5

1.1

Computed Properties

Molecular Weight:204.19
XLogP3:1.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:204.06472551
Monoisotopic Mass:204.06472551
Topological Polar Surface Area:76.5
Heavy Atom Count:15
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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