Cas no 872495-73-3 (Borinic acid, (4-cyanophenyl)ethenyl-)

Borinic acid, (4-cyanophenyl)ethenyl- structure
872495-73-3 structure
Product Name:Borinic acid, (4-cyanophenyl)ethenyl-
CAS No:872495-73-3
MF:C9H7BNO
MW:155.968981981277
CID:658713
PubChem ID:69338810
Update Time:2025-04-19

Borinic acid, (4-cyanophenyl)ethenyl- Chemical and Physical Properties

Names and Identifiers

    • Borinic acid, (4-cyanophenyl)ethenyl-
    • 2-(4-cyanophenyl)ethenyl-hydroxyboron
    • 872495-73-3
    • DTXSID50740287
    • [2-(4-Cyanophenyl)ethenyl](hydroxy)boranyl
    • Inchi: 1S/C9H7BNO/c11-7-9-3-1-8(2-4-9)5-6-10-12/h1-6,12H
    • InChI Key: GXENUWDZBPRYCU-UHFFFAOYSA-N
    • SMILES: O[B]C=CC1C=CC(C#N)=CC=1 |^1:1|

Computed Properties

  • Exact Mass: 156.0620690g/mol
  • Monoisotopic Mass: 156.0620690g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 198
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • Topological Polar Surface Area: 44?2
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