Cas no 61907-78-6 (Benzene, 1,3-bis[1-(4-ethoxyphenyl)-1-methylethyl]-)

Benzene, 1,3-bis[1-(4-ethoxyphenyl)-1-methylethyl]- structure
61907-78-6 structure
Product Name:Benzene, 1,3-bis[1-(4-ethoxyphenyl)-1-methylethyl]-
CAS No:61907-78-6
MF:C28H34O2
MW:402.568368434906
CID:463356
PubChem ID:12296074
Update Time:2025-04-19

Benzene, 1,3-bis[1-(4-ethoxyphenyl)-1-methylethyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1,3-bis[1-(4-ethoxyphenyl)-1-methylethyl]-
    • 1,3-bis[2-(4-ethoxyphenyl)propan-2-yl]benzene
    • 61907-78-6
    • DTXSID60485556
    • Inchi: 1S/C28H34O2/c1-7-29-25-16-12-21(13-17-25)27(3,4)23-10-9-11-24(20-23)28(5,6)22-14-18-26(19-15-22)30-8-2/h9-20H,7-8H2,1-6H3
    • InChI Key: HLZUCTOCOXMGJJ-UHFFFAOYSA-N
    • SMILES: O(CC)C1C=CC(=CC=1)C(C)(C)C1C=CC=C(C=1)C(C)(C)C1C=CC(=CC=1)OCC

Computed Properties

  • Exact Mass: 402.25602
  • Monoisotopic Mass: 402.255880323g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 8
  • Complexity: 451
  • 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
  • XLogP3: 8.2
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • PSA: 18.46
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