Cas no 23751-05-5 (Urea,N-(3-chlorophenyl)-N'-[4-(trifluoromethyl)phenyl]-)

Urea,N-(3-chlorophenyl)-N'-[4-(trifluoromethyl)phenyl]- structure
23751-05-5 structure
Product Name:Urea,N-(3-chlorophenyl)-N'-[4-(trifluoromethyl)phenyl]-
CAS No:23751-05-5
MF:C14H10ClF3N2O
MW:314.690212726593
CID:289622
PubChem ID:266473
Update Time:2025-04-19

Urea,N-(3-chlorophenyl)-N'-[4-(trifluoromethyl)phenyl]- Chemical and Physical Properties

Names and Identifiers

    • Urea,N-(3-chlorophenyl)-N'-[4-(trifluoromethyl)phenyl]-
    • 1-(3-chlorophenyl)-3-[4-(trifluoromethyl)phenyl]urea
    • SCHEMBL161516
    • N'-(3-Chlorophenyl)-N-[4-(trifluoromethyl)phenyl]carbamimidic acid
    • NSC104492
    • DGDUMIJWQJXZHG-UHFFFAOYSA-N
    • 23751-05-5
    • NSC-104492
    • AKOS003949237
    • N-(3-chlorophenyl)-N'-[4-(trifluoromethyl)phenyl]urea
    • DTXSID80946538
    • STK917621
    • MDL: MFCD00504706
    • Inchi: 1S/C14H10ClF3N2O/c15-10-2-1-3-12(8-10)20-13(21)19-11-6-4-9(5-7-11)14(16,17)18/h1-8H,(H2,19,20,21)
    • InChI Key: DGDUMIJWQJXZHG-UHFFFAOYSA-N
    • SMILES: ClC1=CC=CC(=C1)NC(NC1C=CC(C(F)(F)F)=CC=1)=O

Computed Properties

  • Exact Mass: 314.04300
  • Monoisotopic Mass: 314.043
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5
  • Complexity: 357
  • 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
  • Topological Polar Surface Area: 41.1A^2
  • XLogP3: 4

Experimental Properties

  • Density: 1.461
  • Boiling Point: 300.4°Cat760mmHg
  • Flash Point: 135.5°C
  • Refractive Index: 1.613
  • PSA: 41.13000
  • LogP: 5.14880
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