Cas no 62452-62-4 (2-Benzofuranmethanol, acetate)

2-Benzofuranmethanol, acetate structure
2-Benzofuranmethanol, acetate structure
Product Name:2-Benzofuranmethanol, acetate
CAS No:62452-62-4
MF:C11H12O4
MW:208.210583686829
CID:444423
PubChem ID:71386302
Update Time:2025-04-19

2-Benzofuranmethanol, acetate Chemical and Physical Properties

Names and Identifiers

    • 2-Benzofuranmethanol, acetate
    • acetic acid,2-benzofuran-1-ylmethanol
    • 62452-62-4
    • DTXSID20808484
    • Acetic acid--(2-benzofuran-1-yl)methanol (1/1)
    • Inchi: 1S/C9H8O2.C2H4O2/c10-5-9-8-4-2-1-3-7(8)6-11-9;1-2(3)4/h1-4,6,10H,5H2;1H3,(H,3,4)
    • InChI Key: CNMVAIIWYYZGIT-UHFFFAOYSA-N
    • SMILES: O1C=C2C=CC=CC2=C1CO.OC(C)=O

Computed Properties

  • Exact Mass: 208.07356
  • Monoisotopic Mass: 208.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 167
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 70.7?2

Experimental Properties

  • PSA: 70.67
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