Cas no 71754-19-3 (1-(3-cyanophenyl)-3,3-dimethylurea)

1-(3-cyanophenyl)-3,3-dimethylurea structure
71754-19-3 structure
Product Name:1-(3-cyanophenyl)-3,3-dimethylurea
CAS No:71754-19-3
MF:C10H11N3O
MW:189.213841676712
MDL:MFCD19982495
CID:545105
PubChem ID:53534950
Update Time:2025-04-19

1-(3-cyanophenyl)-3,3-dimethylurea Chemical and Physical Properties

Names and Identifiers

    • Urea, N'-(3-cyanophenyl)-N,N-dimethyl-
    • 3-(3-cyanophenyl)-1,1-dimethylurea
    • 1-(3-cyanophenyl)-3,3-dimethylurea
    • SCHEMBL4610082
    • AKOS027753201
    • 71754-19-3
    • CHEMBL2271015
    • N'-(3-Cyanophenyl)-N,N-dimethylurea
    • EN300-83229
    • Z410097646
    • ZDWFQUORZLHJSX-UHFFFAOYSA-N
    • CS-0292204
    • DTXSID20705489
    • MDL: MFCD19982495
    • Inchi: 1S/C10H11N3O/c1-13(2)10(14)12-9-5-3-4-8(6-9)7-11/h3-6H,1-2H3,(H,12,14)
    • InChI Key: ZDWFQUORZLHJSX-UHFFFAOYSA-N
    • SMILES: O=C(NC1C=CC=C(C#N)C=1)N(C)C

Computed Properties

  • Exact Mass: 189.09033
  • Monoisotopic Mass: 189.090211983g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 253
  • 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: 1.1
  • Topological Polar Surface Area: 56.1?2

Experimental Properties

  • PSA: 56.13

1-(3-cyanophenyl)-3,3-dimethylurea Pricemore >>

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