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CS-W001157 4
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1-(3-Chloro-4-methylphenyl)thiourea

  • CAS No. 117174-84-2

  • Cat. No. CS-0153458
  • Molecule weight200.69
  • Purity95+%
  • MDL No.MFCD00060443

*For research and further manufacturing use only, not for direct human use.

1-(3-Chloro-4-methylphenyl)thiourea|CS-0153458

Structure of 117174-84-2

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General Information

  • CAS No. 117174-84-2
  • Cat. No. CS-0153458
  • Purity 95+%
  • MDL No. MFCD00060443
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉ClN₂S
  • Molecular Weight 200.69
  • Synonym(s) Thiourea, N-(3-chloro-4-methylphenyl)-
  • SMILES CC1=C(Cl)C=C(NC(N)=S)C=C1

Synthesis

  • Route1
    • null|null
      19241-37-3
    • ~93%
    • 1-(3-Chloro-4-methylphenyl)thiourea|CS-0153458
      117174-84-2

    References

    • CELGENE CORPORATION; MULLER, George, W.; RUCHELMAN, Alexander, L. Patent: WO2010/53732 A1, 2010 ; Location in patent: Page/Page column 75-76 ;
  • Route2
    • null|null
      117174-76-2
    • ~97%
    • 1-(3-Chloro-4-methylphenyl)thiourea|CS-0153458
      117174-84-2

    References

    • Rasmussen, C. R.; Villani, F. J.; Weaner, L. E.; Reynolds, B. E.; Hood, A. R.; et al. Synthesis, 1988 , # 6 p. 456 - 459
  • Route3

    References

    • Narayana; Vijaya Raj; Ashalatha; Kumari, N. Suchetha; Sarojini European Journal of Medicinal Chemistry, 2004 , vol. 39, # 10 p. 867 - 872

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   2.30392
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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