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CS-W001157 4
Total: USD 88.00

5-(Chloromethyl)-3-methylisoxazole

  • CAS No. 40340-41-8

  • Cat. No. CS-0085295
  • Purity≥98%
  • MDL No.MFCD07687105

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

5-(Chloromethyl)-3-methylisoxazole|CS-0085295

Structure of 40340-41-8

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General Information

  • CAS No. 40340-41-8
  • Cat. No. CS-0085295
  • Purity ≥98%
  • MDL No. MFCD07687105
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₆ClNO
  • Molecular Weight 131.56
  • Synonym(s) None
  • SMILES CC1=NOC(CCl)=C1

Synthesis

  • Route1
    • null|null
      107-29-9
    • null|null
      624-65-7
    • ~45%
    • In-stock
      5-(Chloromethyl)-3-methylisoxazole|CS-0085295
      40340-41-8

    References

    • Li, Wen-Tai; Hwang, Der-Ren; Chen, Ching-Ping; Shen, Chien-Wei; Huang, Chen-Long; Chen, Tung-Wei; Lin, Chi-Hung; Chang, Yee-Ling; Chang, Ying-Ying; Lo, Yue-Kan; Tseng, Huan-Yi; Lin, Chu-Chung; Song, Jeng-Shin; Chen, Hua-Chien; Chen, Shu-Jen; Wu, Se-Hui; Chen, Chiung-Tong Journal of Medicinal Chemistry, 2003 , vol. 46, # 9 p. 1706 - 1715
  • Route2
    • null|null
      54813-96-6
    • ~%
    • In-stock
      5-(Chloromethyl)-3-methylisoxazole|CS-0085295
      40340-41-8

    References

    • Ibragimov,I.I. et al. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1977 , vol. 13, p. 1033 Khimiya Geterotsiklicheskikh Soedinenii, 1977 , vol. 13, p. 1278
  • Route3

    References

    • Stagno d'Alcontres; Cuzzocrea Atti della Societa Peloritana di Scienze Fisiche, Matematiche e Naturali, 1957 , vol. 3, p. 179,185

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-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   26.03
  • LogP   1.72182
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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