Cas no 136416-13-2 (2-Propenoic acid, 3-[3-(3-hydroxypropyl)phenyl]-, methyl ester, (E)-)

2-Propenoic acid, 3-[3-(3-hydroxypropyl)phenyl]-, methyl ester, (E)- structure
136416-13-2 structure
Product Name:2-Propenoic acid, 3-[3-(3-hydroxypropyl)phenyl]-, methyl ester, (E)-
CAS No:136416-13-2
MF:C13H16O3
MW:220.264344215393
CID:1241111
Update Time:2024-08-04

2-Propenoic acid, 3-[3-(3-hydroxypropyl)phenyl]-, methyl ester, (E)- Chemical and Physical Properties

Names and Identifiers

    • 2-Propenoic acid, 3-[3-(3-hydroxypropyl)phenyl]-, methyl ester, (E)-
    • 2-Propenoic acid, 3-[3-(3-hydroxypropyl)phenyl]-, methyl ester, (E)- (9CI)
    • Inchi: 1S/C13H16O3/c1-16-13(15)8-7-12-5-2-4-11(10-12)6-3-9-14/h2,4-5,7-8,10,14H,3,6,9H2,1H3/b8-7+
    • InChI Key: YDQZZIMWGDDIAQ-BQYQJAHWSA-N
    • SMILES: C(OC)(=O)/C=C/C1=CC=CC(CCCO)=C1

Computed Properties

  • Exact Mass: 220.10998

Experimental Properties

  • Density: 1.116±0.06 g/cm3(Predicted)
  • Boiling Point: 367.9±22.0 °C(Predicted)
  • PSA: 46.53
  • pka: 15.04±0.10(Predicted)

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