Cas no 825613-03-4 ([1,1'-Biphenyl]-3-carboxaldehyde, 4-hydroxy-5-methoxy-4'-methyl-)

[1,1'-Biphenyl]-3-carboxaldehyde, 4-hydroxy-5-methoxy-4'-methyl- structure
825613-03-4 structure
Product Name:[1,1'-Biphenyl]-3-carboxaldehyde, 4-hydroxy-5-methoxy-4'-methyl-
CAS No:825613-03-4
MF:C15H14O3
MW:242.269864559174
CID:689103
PubChem ID:39224732
Update Time:2025-04-19

[1,1'-Biphenyl]-3-carboxaldehyde, 4-hydroxy-5-methoxy-4'-methyl- Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-3-carboxaldehyde, 4-hydroxy-5-methoxy-4'-methyl-
    • 2-hydroxy-3-methoxy-5-(4-methylphenyl)benzaldehyde
    • DTXSID20653491
    • 4-Hydroxy-5-methoxy-4'-methyl[1,1'-biphenyl]-3-carbaldehyde
    • 825613-03-4
    • Inchi: 1S/C15H14O3/c1-10-3-5-11(6-4-10)12-7-13(9-16)15(17)14(8-12)18-2/h3-9,17H,1-2H3
    • InChI Key: WHINDHPAHJRWPF-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=C(C=O)C=C(C=1)C1C=CC(C)=CC=1)O

Computed Properties

  • Exact Mass: 242.094294304g/mol
  • Monoisotopic Mass: 242.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 271
  • 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: 3.5
  • Topological Polar Surface Area: 46.5?2
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