Cas no 890591-20-5 (1H-Pyrazole-5-carboxylicacid, 3-(4-bromophenyl)-)

1H-Pyrazole-5-carboxylicacid, 3-(4-bromophenyl)- structure
890591-20-5 structure
Product Name:1H-Pyrazole-5-carboxylicacid, 3-(4-bromophenyl)-
CAS No:890591-20-5
MF:C10H7BrN2O2
MW:267.078781366348
CID:714433
PubChem ID:4737228
Update Time:2025-04-19

1H-Pyrazole-5-carboxylicacid, 3-(4-bromophenyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole-5-carboxylicacid, 3-(4-bromophenyl)-
    • 3-(4-BROMOPHENYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID
    • AKOS001063499
    • BS-4864
    • 46413-66-5
    • MFCD06200702
    • 2-CHLORO-3-CYANOPYRIDIN-4-YLBORONICACID
    • 890591-20-5
    • 5-(4-BROMOPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
    • SCHEMBL23803931
    • A912639
    • F3250-0623
    • 1H-Pyrazole-3-carboxylicacid,5-(4-bromophenyl)-
    • VU0607297-1
    • 5-(4-Bromo-phenyl)-2H-pyrazole-3-carboxyli c acid
    • Z56795085
    • DTXSID701008638
    • BB 0239270
    • EN300-13028
    • FT-0679248
    • SCHEMBL1413926
    • AKOS025394694
    • AB12674
    • AKOS000266377
    • 3-(4-Bromophenyl)-1H-pyrazole-5-carboxylic acid, 97%
    • Inchi: 1S/C10H7BrN2O2/c11-7-3-1-6(2-4-7)8-5-9(10(14)15)13-12-8/h1-5H,(H,12,13)(H,14,15)
    • InChI Key: QEOVHDPWTQAMLB-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1)C1C=C(C(=O)O)NN=1

Computed Properties

  • Exact Mass: 265.96900
  • Monoisotopic Mass: 265.96909g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 242
  • 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: 2.4
  • Topological Polar Surface Area: 66?2

Experimental Properties

  • PSA: 65.98000
  • LogP: 2.53740

1H-Pyrazole-5-carboxylicacid, 3-(4-bromophenyl)- Security Information

  • HazardClass:IRRITANT

1H-Pyrazole-5-carboxylicacid, 3-(4-bromophenyl)- Pricemore >>

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