Cas no 89939-91-3 (6,7-Benzofurandiol)

6,7-Benzofurandiol structure
6,7-Benzofurandiol structure
Product Name:6,7-Benzofurandiol
CAS No:89939-91-3
MF:C8H6O3
MW:150.131442546844
CID:712509
PubChem ID:22756138
Update Time:2025-04-19

6,7-Benzofurandiol Chemical and Physical Properties

Names and Identifiers

    • 6,7-Benzofurandiol
    • 1-benzofuran-6,7-diol
    • BENZOFURAN-6,7-DIOL
    • 6,7-Dihydroxy-cumaron
    • FT-0692835
    • DTXSID90628131
    • AC-14918
    • AKOS006285571
    • SCHEMBL11616702
    • 89939-91-3
    • DB-264370
    • Inchi: 1S/C8H6O3/c9-6-2-1-5-3-4-11-8(5)7(6)10/h1-4,9-10H
    • InChI Key: UFZOZLVMNCFAQO-UHFFFAOYSA-N
    • SMILES: O1C=CC2C=CC(=C(C1=2)O)O

Computed Properties

  • Exact Mass: 150.03200
  • Monoisotopic Mass: 150.032
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 148
  • 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
  • Topological Polar Surface Area: 53.6A^2
  • Surface Charge: 0
  • Tautomer Count: 10
  • XLogP3: 1.6

Experimental Properties

  • Density: 1.454
  • Boiling Point: 310.3°C at 760 mmHg
  • Flash Point: 141.5°C
  • Refractive Index: 1.706
  • PSA: 53.60000
  • LogP: 1.84400

6,7-Benzofurandiol Pricemore >>

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