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CS-W001157 4
Total: USD 88.00

1-Aminobutan-2-one hydrochloride

  • CAS No. 108661-54-7

  • Cat. No. CS-W005374
  • Purity≥98%
  • MDL No.MFCD13152262

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

1-Aminobutan-2-one hydrochloride|CS-W005374

Structure of 108661-54-7

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General Information

  • CAS No. 108661-54-7
  • Cat. No. CS-W005374
  • Purity ≥98%
  • MDL No. MFCD13152262
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₁₀ClNO
  • Molecular Weight 123.58
  • Synonym(s) None
  • SMILES CCC(CN)=O.[H]Cl

Synthesis

  • Route1
    • Benzyl (2-oxobutyl)carbamate|CS-0296053
      224441-65-0
    • ~99%
    • In-stock
      1-Aminobutan-2-one hydrochloride|CS-W005374
      108661-54-7

    References

    • Kim, Kyoung Soon; Kimball, S. David; Misra, Raj N.; Rawlins, David B.; Hunt, John T.; Xiao, Hai-Yun; Lu, Songfeng; Qian, Ligang; Han, Wen-Ching; Shan, Weifang; Mitt, Toomas; Cai, Zhen-Wei; Poss, Michael A.; Zhu, Hong; Sack, John S.; Tokarski, John S.; Chang, Chieh Ying; Pavletich, Nikola; Kamath, Amrita; Humphreys, William G.; Marathe, Punit; Bursuker, Isia; Kellar, Kristen A.; Roongta, Urvashi; Batorsky, Roberta; Mulheron, Janet G.; Bol, David; Fairchild, Craig R.; Lee, Francis Y.; Webster, Kevin R. Journal of Medicinal Chemistry, 2002 , vol. 45, # 18 p. 3905 - 3927
  • Route2
    • 1-Nitrobutan-2-One|CS-0764586
      22920-77-0
    • ~83%
    • In-stock
      1-Aminobutan-2-one hydrochloride|CS-W005374
      108661-54-7

    References

    • Tamura, Rui; Oda, Daihei; Kurokawa, Hiroshi Tetrahedron Letters, 1986 , vol. 27, # 47 p. 5759 - 5762
  • Route3

    References

    • Armarego, Wilfred L. F.; Taguchi, Hiroyasu; Cotton, Richard G. H.; Battiston, Sandra; Leong, Lillian European Journal of Medicinal Chemistry, 1987 , vol. 22, p. 283 - 292

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   0.346
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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