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CS-W001157 4
Total: USD 88.00

1-(4-Fluorophenyl)-2-thiourea

  • CAS No. 459-05-2

  • Cat. No. CS-W001574
  • Purity≥97%
  • MDL No.MFCD00041180

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

1-(4-Fluorophenyl)-2-thiourea|CS-W001574

Structure of 459-05-2

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General Information

  • CAS No. 459-05-2
  • Cat. No. CS-W001574
  • Purity ≥97%
  • MDL No. MFCD00041180
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇FN₂S
  • Molecular Weight 170.21
  • Synonym(s) 4-FLUOROPHENYLTHIOUREA
  • SMILES S=C(N)NC1=CC=C(F)C=C1

Synthesis

  • Route1
    • N-((4-fluorophenyl)carbamothioyl)benzamide|CS-0556314
      399-07-5
    • ~92%
    • In-stock
      1-(4-Fluorophenyl)-2-thiourea|CS-W001574
      459-05-2

    References

    • COUNCIL OF SCIENTIFIC and INDUSTRIAL RESEARCH; SINGH, Supriya; ROY, Kuldeep Kumar; SHARMA, Sandeep Kumar; SRIVASTAVA, Ranjana; CHATURVEDI, Vinita; SAXENA, Anil Kumar Patent: WO2012/164572 A1, 2012 ; Location in patent: Page/Page column 35 ;
  • Route2
    • N-((4-fluorophenyl)carbamothioyl)benzamide|CS-0556314
      399-07-5
    • ~43%
    • N-(4-fluorophenyl)benzamide|CS-0314067
      366-75-6
    • In-stock
      1-(4-Fluorophenyl)-2-thiourea|CS-W001574
      459-05-2

    References

    • Saxena, Anil K.; Pandey, Suresh K.; Seth; Singh; Dikshit; Carpy Bioorganic and Medicinal Chemistry, 2001 , vol. 9, # 8 p. 2025 - 2034
  • Route3
    • null|null
      371-40-4
    • ~%
    • In-stock
      1-(4-Fluorophenyl)-2-thiourea|CS-W001574
      459-05-2

    References

    • Dyson et al. Journal of the Indian Chemical Society, 1931 , vol. 8, p. 147,163

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H319
Precautionary Statements : P264-P270-P280-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   1.4812
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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