Cas no 13249-77-9 (6,7,8,9-Tetrahydro-5H-benzocyclohepten-6-OL)

6,7,8,9-Tetrahydro-5H-benzocyclohepten-6-OL structure
13249-77-9 structure
Product Name:6,7,8,9-Tetrahydro-5H-benzocyclohepten-6-OL
CAS No:13249-77-9
MF:C11H14O
MW:162.228263378143
CID:2904919
PubChem ID:4461141
Update Time:2025-04-21

6,7,8,9-Tetrahydro-5H-benzocyclohepten-6-OL Chemical and Physical Properties

Names and Identifiers

    • 13249-77-9
    • 653-348-6
    • 6,7,8,9-Tetrahydro-5H-benzocyclohepten-6-OL
    • 6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ol
    • 6,7,8,9-tetrahydro-5H-benzo[a]cyclohepten-6-ol
    • SCHEMBL13482664
    • AKOS024323836
    • Inchi: 1S/C11H14O/c12-11-7-3-6-9-4-1-2-5-10(9)8-11/h1-2,4-5,11-12H,3,6-8H2
    • InChI Key: OBSUHLMQAWNOPN-UHFFFAOYSA-N
    • SMILES: OC1CC2C=CC=CC=2CCC1

Computed Properties

  • Exact Mass: 162.104465066g/mol
  • Monoisotopic Mass: 162.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 144
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 20.2?2
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