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CS-W001157 4
Total: USD 88.00

4-((4-Chloro-3,5-bis(difluoromethyl)-1h-pyrazol-1-yl)methyl)benzoic acid

  • CAS No. 1005583-00-5

  • Cat. No. CS-0268131
  • Purity≥98%
  • MDL No.None

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

4-((4-Chloro-3,5-bis(difluoromethyl)-1h-pyrazol-1-yl)methyl)benzoic acid|CS-0268131

Structure of 1005583-00-5

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General Information

  • CAS No. 1005583-00-5
  • Cat. No. CS-0268131
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉ClF₄N₂O₂
  • Molecular Weight 336.67
  • Synonym(s) 4-{[4-Chloro-3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}benzoic acid
  • SMILES C1=C(C=CC(=C1)C(=O)O)CN2C(=C(C(=N2)C(F)F)Cl)C(F)F

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   4.1582
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   5

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