Cas no 589489-33-8 (Benzoic acid, 4-hydroxy-, (3-ethoxyphenyl)methyl ester)

Benzoic acid, 4-hydroxy-, (3-ethoxyphenyl)methyl ester structure
589489-33-8 structure
Product Name:Benzoic acid, 4-hydroxy-, (3-ethoxyphenyl)methyl ester
CAS No:589489-33-8
MF:C16H16O4
MW:272.295845031738
CID:1614947
Update Time:2024-09-11

Benzoic acid, 4-hydroxy-, (3-ethoxyphenyl)methyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 4-hydroxy-, (3-ethoxyphenyl)methyl ester
    • Inchi: 1S/C16H16O4/c1-2-19-15-5-3-4-12(10-15)11-20-16(18)13-6-8-14(17)9-7-13/h3-10,17H,2,11H2,1H3
    • InChI Key: DUSLLCPOIRIVPD-UHFFFAOYSA-N
    • SMILES: C(OCC1=CC=CC(OCC)=C1)(=O)C1=CC=C(O)C=C1

Computed Properties

  • Exact Mass: 272.10488

Experimental Properties

  • Density: 1.199±0.06 g/cm3(Predicted)
  • Boiling Point: 436.9±25.0 °C(Predicted)
  • PSA: 55.76
  • pka: 8.11±0.15(Predicted)
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