Cas no 51108-53-3 (1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole)

1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole structure
51108-53-3 structure
Product Name:1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole
CAS No:51108-53-3
MF:C12H13BrN2
MW:265.149021863937
MDL:MFCD18071275
CID:363230
PubChem ID:12203513
Update Time:2025-04-19

1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole hydrochloride
    • 1H-Pyrazole, 4-bromo-3,5-dimethyl-1-(phenylmethyl)-
    • 1-Benzyl-4-brom-3,5-dimethylpyrazol
    • 1-benzyl-4-bromo-1H-pyrazole
    • 1-benzyl-4-bromo-3,5-dimethyl-1H-pyrazole
    • 1-Benzyl-4-bromo-3,5-dimethylpyrazole
    • 4-Brom-1-benzyl-3,5-dimethylpyrazol
    • 4-Brom-3,5-dimethyl-1-benzylpyrazol
    • 4-bromo-1-benzyl-1H-pyrazole
    • 4-bromo-1-benzylpyrazole
    • 4-bromo-N-benzylpyrazole
    • AC1MGP04
    • ACMC-1AYN8
    • AG-664
    • N-benzyl-4-bromopyrazole
    • SureCN671242
    • TPC-I137
    • 51108-53-3
    • CS-0358101
    • VS-09095
    • E89524
    • A1-26011
    • AKOS005174624
    • EN300-1870615
    • 1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole
    • MDL: MFCD18071275
    • Inchi: 1S/C12H13BrN2/c1-9-12(13)10(2)15(14-9)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3
    • InChI Key: ROPFJPYTHVCUJW-UHFFFAOYSA-N
    • SMILES: BrC1C(C)=NN(C=1C)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 264.02629
  • Monoisotopic Mass: 264.02621g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 204
  • 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: 3.3
  • Topological Polar Surface Area: 17.8?2

Experimental Properties

  • PSA: 17.82

1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole Security Information

  • HazardClass:IRRITANT

1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole Pricemore >>

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