Cas no 4500-59-8 (Thiourea,N-(2-ethylphenyl)-N'-phenyl-)

Thiourea,N-(2-ethylphenyl)-N'-phenyl- structure
4500-59-8 structure
Product Name:Thiourea,N-(2-ethylphenyl)-N'-phenyl-
CAS No:4500-59-8
MF:C15H16N2S
MW:256.365942001343
CID:333164
PubChem ID:879752
Update Time:2025-04-19

Thiourea,N-(2-ethylphenyl)-N'-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Thiourea,N-(2-ethylphenyl)-N'-phenyl-
    • 2-Aethyl-diphenyl-thioharnstoff
    • 3-(2-ethylphenyl)-1-methyl-thiourea
    • AC1N31IT
    • CTK2F6565
    • N-(2-Aethyl-phenyl)-N'-methyl-thioharnstoff
    • N-(2-Aethyl-phenyl)-N'-phenyl-thioharnstoff
    • N-(2-ethyl-phenyl)-N'-methyl-thiourea
    • N-(2-ethyl-phenyl)-N'-phenyl-thiourea
    • NSC204805
    • DTXSID10358185
    • NSC-191414
    • AB00104345-01
    • NSC191414
    • AKOS000388879
    • 4500-59-8
    • 1-(2-ethylphenyl)-3-phenylthiourea
    • 460090-53-3
    • SCHEMBL6955646
    • N-(2-ethylphenyl)-N'-phenylthiourea
    • Inchi： 1S/C15H16N2S/c1-2-12-8-6-7-11-14(12)17-15(18)16-13-9-4-3-5-10-13/h3-11H,2H2,1H3,(H2,16,17,18)
    • InChI Key： HHYSWXMNCXPMNO-UHFFFAOYSA-N
    • SMILES： S=C(NC1C=CC=CC=1)NC1C=CC=CC=1CC

Computed Properties

  • Exact Mass: 256.10358
  • Monoisotopic Mass: 256.103
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 261
  • 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: 3.3
  • Topological Polar Surface Area: 56.2?2

Experimental Properties

  • Density: 1.217g/cm3
  • Boiling Point: 374.6oC at 760 mmHg
  • Flash Point: 180.4oC
  • Refractive Index: 1.705
  • PSA: 24.06
  • LogP: 4.20390

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