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CS-W001157 4
Total: USD 88.00

2-[(4-Methylphenyl)thio]ethanamine

  • CAS No. 42404-23-9

  • Cat. No. CS-0212929
  • Molecule weight167.27
  • Purity≥95%
  • MDL No.MFCD04055859

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

2-[(4-Methylphenyl)thio]ethanamine|CS-0212929

Structure of 42404-23-9

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General Information

  • CAS No. 42404-23-9
  • Cat. No. CS-0212929
  • Purity ≥95%
  • MDL No. MFCD04055859
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₃NS
  • Molecular Weight 167.27
  • Synonym(s) None
  • SMILES CC1=CC=C(C=C1)SCCN

Synthesis

  • Route1
    • 2-Chloroethanamine hydrochloride Ifosfamide  Impurity|CS-0229451
      870-24-6
    • null|null
      106-45-6
    • ~95%
    • 2-[(4-Methylphenyl)thio]ethanamine|CS-0212929
      42404-23-9

    References

    • Deng, Shixian; Belvedere, Sandro; Yan, Jiaming; Landry, Donald Patent: US2009/227788 A1, 2009 ; Location in patent: Page/Page column 20 ;
  • Route2

    References

    • Ishibashi, Hiroyuki; Uegaki, Masayuki; Sakai, Manami Synlett, 1997 , vol. 1997, # 8 p. 915 - 916
  • Route3
    • null|null
      82772-76-7
    • ~93%
    • 2-[(4-Methylphenyl)thio]ethanamine|CS-0212929
      42404-23-9

    References

    • Pirl, Joerg N.; Bell, Charles L.; Bauer, Ludwig Journal of Organic Chemistry, 1982 , vol. 47, # 20 p. 3971 - 3974

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.04582
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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