Cas no 2228650-85-7 (2-(4-ethynylphenyl)prop-2-enoic acid)

2-(4-ethynylphenyl)prop-2-enoic acid structure
2228650-85-7 structure
Product Name:2-(4-ethynylphenyl)prop-2-enoic acid
CAS No:2228650-85-7
MF:C11H8O2
MW:172.180023193359
CID:5819512
PubChem ID:165764674
Update Time:2023-12-27

2-(4-ethynylphenyl)prop-2-enoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(4-ethynylphenyl)prop-2-enoic acid
    • EN300-1763026
    • 2228650-85-7
    • Inchi: 1S/C11H8O2/c1-3-9-4-6-10(7-5-9)8(2)11(12)13/h1,4-7H,2H2,(H,12,13)
    • InChI Key: BIAVFQRDFDXXPT-UHFFFAOYSA-N
    • SMILES: OC(C(=C)C1C=CC(C#C)=CC=1)=O

Computed Properties

  • Exact Mass: 172.052429494g/mol
  • Monoisotopic Mass: 172.052429494g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 261
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 37.3?2

2-(4-ethynylphenyl)prop-2-enoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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