Cas no 397843-56-0 (Boronic acid, [3-[[(phenylmethyl)amino]methyl]phenyl]-)

Boronic acid, [3-[[(phenylmethyl)amino]methyl]phenyl]- structure
397843-56-0 structure
Product Name:Boronic acid, [3-[[(phenylmethyl)amino]methyl]phenyl]-
CAS No:397843-56-0
MF:C14H16BNO2
MW:241.093343734741
CID:1510858
Update Time:2024-08-24

Boronic acid, [3-[[(phenylmethyl)amino]methyl]phenyl]- Chemical and Physical Properties

Names and Identifiers

    • Boronic acid, [3-[[(phenylmethyl)amino]methyl]phenyl]-
    • Boronic acid, [3-[[(phenylmethyl)amino]methyl]phenyl]- (9CI)
    • 3-[[(Phenylmethyl)amino]methyl]phenylboronic acid
    • Inchi: 1S/C14H16BNO2/c17-15(18)14-8-4-7-13(9-14)11-16-10-12-5-2-1-3-6-12/h1-9,16-18H,10-11H2
    • InChI Key: AOKRPJJWZYXJDI-UHFFFAOYSA-N
    • SMILES: C1(B(O)O)=CC=CC(CNCC2=CC=CC=C2)=C1

Computed Properties

  • Exact Mass: 240.13108

Experimental Properties

  • Density: 1.16±0.1 g/cm3(Predicted)
  • Boiling Point: 434.7±47.0 °C(Predicted)
  • PSA: 52.49
  • pka: 7.99±0.10(Predicted)

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