Cas no 264-09-5 (7H-Benzocycloheptene)

7H-Benzocycloheptene structure
7H-Benzocycloheptene structure
Product Name:7H-Benzocycloheptene
CAS No:264-09-5
MF:C11H10
MW:142.197103023529
CID:275005
PubChem ID:637504
Update Time:2024-02-28

7H-Benzocycloheptene Chemical and Physical Properties

Names and Identifiers

    • 7H-Benzocycloheptene
    • 3,4-Benzotropilidene
    • BENZOCYCLOHEPTATRIENE
    • Inchi: 1S/C11H10/c1-2-6-10-8-4-5-9-11(10)7-3-1/h2-9H,1H2
    • InChI Key: AATMCCVYMZDTCD-UHFFFAOYSA-N
    • SMILES: C12=CC=CC=C1C=CCC=C2

Computed Properties

  • Exact Mass: 142.0783
  • Monoisotopic Mass: 142.078250319g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 177
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 1.011±0.06 g/cm3(Predicted)
  • Boiling Point: 244.1±20.0 °C(Predicted)
  • PSA: 0

7H-Benzocycloheptene Related Literature

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