Cas no 2740-95-6 (Thiourea,N,N'-dimethyl-N-phenyl-)

Thiourea,N,N'-dimethyl-N-phenyl- structure
2740-95-6 structure
Product Name:Thiourea,N,N'-dimethyl-N-phenyl-
CAS No:2740-95-6
MF:C9H12N2S
MW:180.269980430603
CID:289444
PubChem ID:852750
Update Time:2025-04-19

Thiourea,N,N'-dimethyl-N-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Thiourea,N,N'-dimethyl-N-phenyl-
    • N,N'-dimethyl-N-phenylthiourea
    • 1,3-dimethyl-1-phenylthiourea
    • 1,3-dimethyl-1-phenyl-thiourea
    • 1,3-Dimethyl-3-phenyl-thioharnstoff
    • AG-F-07982
    • CTK4G8520
    • dimethyl phenyl thiourea
    • N,N-Dimethyl-N'-phenylsulfonylharnstoff
    • N,N'-Dimethyl-N-phenyl-thioharnstoff
    • N,N'-dimethyl-N-phenyl-thiourea
    • N-[(DIMETHYLAMINO)CARBONYL]-BENZENESULFONAMIDE
    • N-Phenyl-N,N'-dimethyl-thioharnstoff
    • N-Phenylsulfonyl-N',N'-dimethyl-harnstoff
    • AR-360/42760610
    • MLS000701199
    • N-phenyl-N,N'-dimethylthiourea
    • AKOS026732741
    • N,N'-Dimethyl-N-phenylcarbamimidothioic acid
    • 2740-95-6
    • DIMETHYLPHENYLTHIOUREA
    • CHEMBL1538414
    • NSC-202264
    • 52777-01-2
    • NSC202264
    • DTXSID50950086
    • SCHEMBL14220039
    • SMR000230346
    • SCHEMBL6694830
    • HMS2544B15
    • Inchi: 1S/C9H12N2S/c1-10-9(12)11(2)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,10,12)
    • InChI Key: XOERABXRVAVTCE-UHFFFAOYSA-N
    • SMILES: S=C(NC)N(C)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 180.07226
  • Monoisotopic Mass: 180.07211956g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 153
  • 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: 1.6
  • Topological Polar Surface Area: 47.4?2

Experimental Properties

  • PSA: 15.27
  • LogP: 2.01800

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