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CS-W001157 4
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3-(4-Iodo-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid

  • CAS No. 6645-81-4

  • Cat. No. CS-0205654
  • Molecule weight294.09
  • Purity≥97%
  • MDL No.MFCD09878862

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

3-(4-Iodo-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid|CS-0205654

Structure of 6645-81-4

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General Information

  • CAS No. 6645-81-4
  • Cat. No. CS-0205654
  • Purity ≥97%
  • MDL No. MFCD09878862
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁IN₂O₂
  • Molecular Weight 294.09
  • Synonym(s) None
  • SMILES CC1=NN(CCC(=O)O)C(=C1I)C

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   55.12
  • LogP   1.57924
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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