Cas no 354769-05-4 (3,5-Dimethoxy-benzoic acid biphenyl-4-yl ester)

3,5-Dimethoxy-benzoic acid biphenyl-4-yl ester structure
354769-05-4 structure
Product Name:3,5-Dimethoxy-benzoic acid biphenyl-4-yl ester
CAS No:354769-05-4
MF:C21H18O4
MW:334.365226268768
CID:3053616
PubChem ID:4438894
Update Time:2025-04-21

3,5-Dimethoxy-benzoic acid biphenyl-4-yl ester Chemical and Physical Properties

Names and Identifiers

    • 3,5-Dimethoxy-benzoic acid biphenyl-4-yl ester
    • [1,1'-Biphenyl]-4-yl 3,5-dimethoxybenzoate
    • 662-499-7
    • 354769-05-4
    • AKOS005429798
    • NCGC00340897-01
    • biphenyl-4-yl 3,5-dimethoxybenzoate
    • STK362579
    • Oprea1_487851
    • (1,1'-BIPHENYL)-4-YL 3,5-DIMETHOXYBENZOATE
    • AB01332639-02
    • Inchi: 1S/C21H18O4/c1-23-19-12-17(13-20(14-19)24-2)21(22)25-18-10-8-16(9-11-18)15-6-4-3-5-7-15/h3-14H,1-2H3
    • InChI Key: JKHAFYXKXBSAOE-UHFFFAOYSA-N
    • SMILES: O(C(C1C=C(C=C(C=1)OC)OC)=O)C1C=CC(=CC=1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 334.12050905Da
  • Monoisotopic Mass: 334.12050905Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 6
  • Complexity: 398
  • 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: 4.9
  • Topological Polar Surface Area: 44.8?2
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