Cas no 1782551-27-2 (2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylacetic acid)

2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylacetic acid structure
1782551-27-2 structure
Product Name:2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylacetic acid
CAS No:1782551-27-2
MF:C7H6ClF3N2O2
MW:242.582951068878
CID:5876861
PubChem ID:83899340
Update Time:2024-01-12

2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylacetic acid Chemical and Physical Properties

Names and Identifiers

    • 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylacetic acid
    • EN300-1960677
    • 1782551-27-2
    • 2-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]acetic acid
    • Inchi: 1S/C7H6ClF3N2O2/c1-13-6(8)3(2-4(14)15)5(12-13)7(9,10)11/h2H2,1H3,(H,14,15)
    • InChI Key: ICYJLOUBXMZYJH-UHFFFAOYSA-N
    • SMILES: ClC1=C(CC(=O)O)C(C(F)(F)F)=NN1C

Computed Properties

  • Exact Mass: 242.0069896g/mol
  • Monoisotopic Mass: 242.0069896g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 261
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 55.1?2

2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylacetic acid Pricemore >>

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