Cas no 135008-92-3 (Benzoic acid, 3-[(1E)-2-phenylethenyl]-)

Benzoic acid, 3-[(1E)-2-phenylethenyl]- structure
135008-92-3 structure
Product Name:Benzoic acid, 3-[(1E)-2-phenylethenyl]-
CAS No:135008-92-3
MF:C15H12O2
MW:224.254584312439
CID:1243529
Update Time:2024-08-05

Benzoic acid, 3-[(1E)-2-phenylethenyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 3-[(1E)-2-phenylethenyl]-
    • 3-(2-(E)-phenylethenyl)-benzoic acid
    • Inchi: 1S/C15H12O2/c16-15(17)14-8-4-7-13(11-14)10-9-12-5-2-1-3-6-12/h1-11H,(H,16,17)/b10-9+
    • InChI Key: RHKYEHRKNBWIDK-MDZDMXLPSA-N
    • SMILES: C(O)(=O)C1=CC=CC(/C=C/C2=CC=CC=C2)=C1

Computed Properties

  • Exact Mass: 224.08376

Experimental Properties

  • Density: 1.211±0.06 g/cm3(Predicted)
  • Melting Point: 195 °C
  • Boiling Point: 409.8±25.0 °C(Predicted)
  • PSA: 37.3
  • pka: 4.17±0.10(Predicted)
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