Cas no 1238854-13-1 (5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole)

5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole is a brominated pyrazole derivative with significant utility in organic synthesis and pharmaceutical research. Its key structural features—a bromomethyl group at the 5-position and a 4-bromophenyl substituent at the 3-position—make it a versatile intermediate for further functionalization, particularly in cross-coupling reactions and heterocyclic scaffold construction. The presence of reactive bromine atoms facilitates selective modifications, enabling applications in medicinal chemistry for the development of bioactive compounds. This compound is particularly valued for its stability under standard handling conditions and its compatibility with a range of synthetic methodologies, offering researchers a reliable building block for complex molecular architectures.
5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole structure
1238854-13-1 structure
Product Name:5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole
CAS No:1238854-13-1
MF:C10H8Br2N2
MW:315.991920471191
CID:1029520
PubChem ID:71627139
Update Time:2025-06-09

5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole
    • DTXSID10856515
    • DB-062193
    • 1238854-13-1
    • Inchi: 1S/C10H8Br2N2/c11-6-9-5-10(14-13-9)7-1-3-8(12)4-2-7/h1-5H,6H2,(H,13,14)
    • InChI Key: FGZKXARZJWYBAM-UHFFFAOYSA-N
    • SMILES: BrCC1=CC(C2C=CC(=CC=2)Br)=NN1

Computed Properties

  • Exact Mass: 315.90337g/mol
  • Monoisotopic Mass: 313.90542g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • 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: 3.2
  • Topological Polar Surface Area: 28.7?2

5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
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1238854-13-1 95%
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Chemenu
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Chemenu
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SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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1238854-13-1 98%
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¥2720.00 2024-08-09

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