Cas no 102991-08-2 (Acetic acid, hydroxy-, (4-methoxyphenyl)methyl ester)

Acetic acid, hydroxy-, (4-methoxyphenyl)methyl ester structure
102991-08-2 structure
Product Name:Acetic acid, hydroxy-, (4-methoxyphenyl)methyl ester
CAS No:102991-08-2
MF:C10H12O4
MW:196.199883460999
CID:1135391
Update Time:2024-07-27

Acetic acid, hydroxy-, (4-methoxyphenyl)methyl ester Chemical and Physical Properties

Names and Identifiers

    • Acetic acid, hydroxy-, (4-methoxyphenyl)methyl ester
    • Acetic acid, 2-hydroxy-, (4-methoxyphenyl)methyl ester
    • Inchi: 1S/C10H12O4/c1-13-9-4-2-8(3-5-9)7-14-10(12)6-11/h2-5,11H,6-7H2,1H3
    • InChI Key: NBBDCFZVMVAUSI-UHFFFAOYSA-N
    • SMILES: C(OCC1=CC=C(OC)C=C1)(=O)CO

Computed Properties

  • Exact Mass: 196.07356

Experimental Properties

  • Density: 1.198±0.06 g/cm3(Predicted)
  • Boiling Point: 318.0±22.0 °C(Predicted)
  • PSA: 55.76
  • pka: 12.90±0.10(Predicted)
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