Cas no 179128-84-8 (2-Propenoic acid, 3-[3,4-bis(2-propenyloxy)phenyl]-, (2E)-)

2-Propenoic acid, 3-[3,4-bis(2-propenyloxy)phenyl]-, (2E)- structure
179128-84-8 structure
Product Name:2-Propenoic acid, 3-[3,4-bis(2-propenyloxy)phenyl]-, (2E)-
CAS No:179128-84-8
MF:C15H16O4
MW:260.285144805908
CID:3817813
PubChem ID:11129044
Update Time:2025-04-22

2-Propenoic acid, 3-[3,4-bis(2-propenyloxy)phenyl]-, (2E)- Chemical and Physical Properties

Names and Identifiers

    • 2-Propenoic acid, 3-[3,4-bis(2-propenyloxy)phenyl]-, (2E)-
    • 2-Propenoic acid, 3-[3,4-bis(2-propen-1-yloxy)phenyl]-, (2E)-
    • 3,4-di-O-allylcaffeic acid
    • (E)-3-(3,4-BIS-ALLYLOXY-PHENYL)-ACRYLIC ACID
    • SCHEMBL13610525
    • F95953
    • AKOS015967647
    • CHEMBL4516231
    • 179128-84-8
    • Inchi: 1S/C15H16O4/c1-3-9-18-13-7-5-12(6-8-15(16)17)11-14(13)19-10-4-2/h3-8,11H,1-2,9-10H2,(H,16,17)/b8-6+
    • InChI Key: UKTUNYIJSCLNBF-SOFGYWHQSA-N
    • SMILES: C(O)(=O)/C=C/C1=CC=C(OCC=C)C(OCC=C)=C1

Computed Properties

  • Exact Mass: 260.10485899Da
  • Monoisotopic Mass: 260.10485899Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 8
  • Complexity: 335
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.1
  • Topological Polar Surface Area: 55.8?2
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