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3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid

  • CAS No. 796845-50-6

  • Cat. No. CS-0058342
  • Molecule weight154.17
  • Purity≥98%
  • MDL No.MFCD06808507

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

3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid|CS-0058342

Structure of 796845-50-6

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General Information

  • CAS No. 796845-50-6
  • Cat. No. CS-0058342
  • Purity ≥98%
  • MDL No. MFCD06808507
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀N₂O₂
  • Molecular Weight 154.17
  • Synonym(s) 3-(2-methylpyrazol-3-yl)propionic acid
  • SMILES O=C(O)CCC1=CC=NN1C

Synthesis

  • Route1
    • null|null
      796845-49-3
    • ~71%
    • In-stock
      3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid|CS-0058342
      796845-50-6

    References

    • Murano, Kenji; Yamanaka, Toshio; Toda, Ayako; Ohki, Hidenori; Okuda, Shinya; Kawabata, Kohji; Hatano, Kazuo; Takeda, Shinobu; Akamatsu, Hisashi; Itoh, Kenji; Misumi, Keiji; Inoue, Satoshi; Takagi, Tatsuya Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 5 p. 2261 - 2275

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   55.12
  • LogP   0.4373
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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