Cas no 65317-00-2 (Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene,5,15-dimethoxy-)

Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene,5,15-dimethoxy- structure
65317-00-2 structure
Product Name:Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene,5,15-dimethoxy-
CAS No:65317-00-2
MF:C18H20O2
MW:268.350205421448
CID:526979
PubChem ID:144119
Update Time:2025-04-19

Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene,5,15-dimethoxy- Chemical and Physical Properties

Names and Identifiers

    • Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene,5,15-dimethoxy-
    • [2.2]-Paracyclophane, 2,5-dimethoxy-
    • Inchi: 1S/C18H20O2/c1-19-17-11-16-10-8-14-5-3-13(4-6-14)7-9-15(17)12-18(16)20-2/h3-6,11-12H,7-10H2,1-2H3
    • InChI Key: CLFMRMYRIJJZAH-UHFFFAOYSA-N
    • SMILES: O(C)C1C=C2C(=CC=1CCC1C=CC(=CC=1)CC2)OC

Computed Properties

  • Exact Mass: 268.1464
  • Monoisotopic Mass: 268.14633
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 266
  • 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: 18.5
  • XLogP3: 4.4

Experimental Properties

  • Density: 1.075
  • Boiling Point: 423.1°Cat760mmHg
  • Flash Point: 169°C
  • Refractive Index: 1.562
  • PSA: 18.46
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