Cas no 34114-06-2 (1-(4-chlorophenyl)-3-formylurea)

1-(4-chlorophenyl)-3-formylurea structure
34114-06-2 structure
Product Name:1-(4-chlorophenyl)-3-formylurea
CAS No:34114-06-2
MF:C8H7ClN2O2
MW:198.606380701065
CID:1461509
PubChem ID:190322
Update Time:2025-04-20

1-(4-chlorophenyl)-3-formylurea Chemical and Physical Properties

Names and Identifiers

    • 1-(4-chlorophenyl)-3-formylurea
    • N-[(4-Chlorophenyl)carbamoyl]formamide
    • 34114-06-2
    • N-((4-Chlorophenyl)carbamoyl)formamide
    • DTXSID40187708
    • Inchi: 1S/C8H7ClN2O2/c9-6-1-3-7(4-2-6)11-8(13)10-5-12/h1-5H,(H2,10,11,12,13)
    • InChI Key: SMKHKKHWVZVVBQ-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1)NC(NC=O)=O

Computed Properties

  • Exact Mass: 198.01971
  • Monoisotopic Mass: 198.0196052g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 191
  • 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: 2.2
  • Topological Polar Surface Area: 58.2?2

Experimental Properties

  • PSA: 58.2
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