Cas no 893637-93-9 ([1,1'-Biphenyl]-4-carboxaldehyde,4'-chloro-3'-(trifluoromethyl)-)

[1,1'-Biphenyl]-4-carboxaldehyde,4'-chloro-3'-(trifluoromethyl)- structure
893637-93-9 structure
Product Name:[1,1'-Biphenyl]-4-carboxaldehyde,4'-chloro-3'-(trifluoromethyl)-
CAS No:893637-93-9
MF:C14H8ClF3O
MW:284.660933494568
CID:714589
PubChem ID:23005073
Update Time:2025-04-19

[1,1'-Biphenyl]-4-carboxaldehyde,4'-chloro-3'-(trifluoromethyl)- Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-4-carboxaldehyde,4'-chloro-3'-(trifluoromethyl)-
    • 4-(4-Chloro-3-(trifluoromethyl)phenyl)benzaldehyde
    • 4-[4-chloro-3-(trifluoromethyl)phenyl]benzaldehyde
    • [1,1'-Biphenyl]-4-carboxaldehyde,4'-chloro-3'-(trifluoromethyl)
    • 4'-Chloro-3'-(trifluoromethyl)[1,1'-biphenyl]-4-carbaldehyde
    • AKOS004116945
    • SCHEMBL17115582
    • DTXSID30629602
    • 893637-93-9
    • Inchi： 1S/C14H8ClF3O/c15-13-6-5-11(7-12(13)14(16,17)18)10-3-1-9(8-19)2-4-10/h1-8H
    • InChI Key： FZVSATUMZPHEQL-UHFFFAOYSA-N
    • SMILES： ClC1C=CC(=CC=1C(F)(F)F)C1C=CC(C=O)=CC=1

Computed Properties

  • Exact Mass: 284.02200
  • Monoisotopic Mass: 284.0215771g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 310
  • 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: 4.5
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 4.83830

[1,1'-Biphenyl]-4-carboxaldehyde,4'-chloro-3'-(trifluoromethyl)- Related Literature

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