Cas no 885963-72-4 ([1,1'-Biphenyl]-3-carboxaldehyde,3',5'-bis(trifluoromethyl)-)

[1,1'-Biphenyl]-3-carboxaldehyde,3',5'-bis(trifluoromethyl)- structure
885963-72-4 structure
Product Name:[1,1'-Biphenyl]-3-carboxaldehyde,3',5'-bis(trifluoromethyl)-
CAS No:885963-72-4
MF:C15H14O3
MW:242.269864559174
CID:712005
PubChem ID:53425004
Update Time:2025-04-19

[1,1'-Biphenyl]-3-carboxaldehyde,3',5'-bis(trifluoromethyl)- Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-3-carboxaldehyde,3',5'-bis(trifluoromethyl)-
    • 3-(2,3-Dimethoxyphenyl)benzaldehyde
    • [1,1'-Biphenyl]-3-carboxaldehyde,3',5'-bis(trifluoromethyl)
    • 3-(2,4-Dihydroxyphenyl)benzaldehyde
    • 3-(2,5-Dihydroxyphenyl)benzaldehyde
    • 3-(3,4-Dihydroxyphenyl)benzaldehyde
    • 3-(3,5-Bis(trifluoromethyl)phenyl)benzaldehyde
    • DTXSID60698689
    • 885963-72-4
    • EN300-764864
    • 1545398-69-3
    • 2',3'-Dimethoxy[1,1'-biphenyl]-3-carbaldehyde
    • AKOS021113067
    • Inchi: 1S/C15H14O3/c1-17-14-8-4-7-13(15(14)18-2)12-6-3-5-11(9-12)10-16/h3-10H,1-2H3
    • InChI Key: HYJWNSAWSHRGJI-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=CC=CC=1C1C=CC=C(C=O)C=1)OC

Computed Properties

  • Exact Mass: 242.09400
  • Monoisotopic Mass: 242.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 267
  • 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
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • PSA: 35.53000
  • LogP: 3.18330

[1,1'-Biphenyl]-3-carboxaldehyde,3',5'-bis(trifluoromethyl)- Related Literature

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