Cas no 1171748-83-6 (1-Butyl-3-methyl-5-nitro-1H-pyrazole)

1-Butyl-3-methyl-5-nitro-1H-pyrazole structure
1171748-83-6 structure
Product Name:1-Butyl-3-methyl-5-nitro-1H-pyrazole
CAS No:1171748-83-6
MF:C8H13N3O2
MW:183.207721471786
CID:3158737
PubChem ID:25247431
Update Time:2025-04-21

1-Butyl-3-methyl-5-nitro-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 1-Butyl-3-methyl-5-nitro-1H-pyrazole
    • 1-butyl-3-methyl-5-nitropyrazole
    • 1171748-83-6
    • STK351578
    • AKOS005167496
    • AKOS015922101
    • MDL： MFCD09468154
    • Inchi： 1S/C8H13N3O2/c1-3-4-5-10-8(11(12)13)6-7(2)9-10/h6H,3-5H2,1-2H3
    • InChI Key： JMCVLUCKGMBXNU-UHFFFAOYSA-N
    • SMILES： [O-][N+](C1=CC(C)=NN1CCCC)=O

Computed Properties

  • Exact Mass: 183.100776666Da
  • Monoisotopic Mass: 183.100776666Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 181
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 63.6?2

1-Butyl-3-methyl-5-nitro-1H-pyrazole Pricemore >>

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