Cas no 223137-67-5 (1,5-Bis(3-methoxyphenyl)pentan-3-one)

1,5-Bis(3-methoxyphenyl)pentan-3-one structure
223137-67-5 structure
Product Name:1,5-Bis(3-methoxyphenyl)pentan-3-one
CAS No:223137-67-5
MF:C19H22O3
MW:298.376185894012
CID:2191046
PubChem ID:15493705
Update Time:2025-04-21

1,5-Bis(3-methoxyphenyl)pentan-3-one Chemical and Physical Properties

Names and Identifiers

    • 1,5-Bis(3-methoxyphenyl)pentan-3-one
    • DTXCID20524056
    • 3-Pentanone, 1,5-bis(3-methoxyphenyl)-
    • 223137-67-5
    • DB-291119
    • DTXSID00573284
    • SCHEMBL7332474
    • Inchi: 1S/C19H22O3/c1-21-18-7-3-5-15(13-18)9-11-17(20)12-10-16-6-4-8-19(14-16)22-2/h3-8,13-14H,9-12H2,1-2H3
    • InChI Key: YEBCBFAFMHCZNW-UHFFFAOYSA-N
    • SMILES: O=C(CCC1C=CC=C(C=1)OC)CCC1C=CC=C(C=1)OC

Computed Properties

  • Exact Mass: 298.15689456Da
  • Monoisotopic Mass: 298.15689456Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 8
  • Complexity: 299
  • 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: 3.7
  • Topological Polar Surface Area: 35.5?2
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