Cas no 1028530-42-8 (3'-Nitrobiphenyl-4-ylboronic acid)

3'-Nitrobiphenyl-4-ylboronic acid structure
1028530-42-8 structure
Product Name:3'-Nitrobiphenyl-4-ylboronic acid
CAS No:1028530-42-8
MF:C12H10BNO4
MW:243.023103237152
CID:3164745
PubChem ID:16244488
Update Time:2025-04-21

3'-Nitrobiphenyl-4-ylboronic acid Chemical and Physical Properties

Names and Identifiers

    • 3'-nitrobiphenyl-4-ylboronic acid
    • {3'-nitro-[1,1'-biphenyl]-4-yl}boronic acid
    • 3'-nitrobiphenyl-4-boronic acid
    • (3'-Nitro-[1,1'-biphenyl]-4-yl)boronic acid
    • [4-(3-nitrophenyl)phenyl]boronic acid
    • 1028530-42-8
    • 3'-Nitrobiphenyl-4-ylboronic acid
    • Inchi: 1S/C12H10BNO4/c15-13(16)11-6-4-9(5-7-11)10-2-1-3-12(8-10)14(17)18/h1-8,15-16H
    • InChI Key: URDVMFHJXZWNCS-UHFFFAOYSA-N
    • SMILES: OB(C1C=CC(=CC=1)C1C=CC=C(C=1)[N+](=O)[O-])O

Computed Properties

  • Exact Mass: 243.070288g/mol
  • Monoisotopic Mass: 243.070288g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 286
  • 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
  • Molecular Weight: 243.02g/mol
  • Topological Polar Surface Area: 86.3?2
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