Cas no 140480-85-9 (Benzoic acid, 2-formyl-3,5-dihydroxy-4-(hydroxymethyl)-)

Benzoic acid, 2-formyl-3,5-dihydroxy-4-(hydroxymethyl)- structure
140480-85-9 structure
Product Name:Benzoic acid, 2-formyl-3,5-dihydroxy-4-(hydroxymethyl)-
CAS No:140480-85-9
MF:C9H8O6
MW:212.156223297119
CID:1294164
Update Time:2024-08-03

Benzoic acid, 2-formyl-3,5-dihydroxy-4-(hydroxymethyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 2-formyl-3,5-dihydroxy-4-(hydroxymethyl)-
    • Inchi: 1S/C9H8O6/c10-2-5-4(9(14)15)1-7(12)6(3-11)8(5)13/h1-2,11-13H,3H2,(H,14,15)
    • InChI Key: UDUIGHPTNBWQKT-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C1=CC(O)=C(CO)C(O)=C1C=O

Computed Properties

  • Exact Mass: 212.03204

Experimental Properties

  • Density: 1.706±0.06 g/cm3(Predicted)
  • Boiling Point: 530.8±39.0 °C(Predicted)
  • PSA: 115.06
  • pka: 4.29±0.10(Predicted)
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