Cas no 2171990-19-3 (3-(difluoromethyl)-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid)

3-(difluoromethyl)-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid structure
2171990-19-3 structure
Product Name:3-(difluoromethyl)-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid
CAS No:2171990-19-3
MF:C8H10F2N2O2
MW:204.174008846283
CID:5032319
PubChem ID:129892185
Update Time:2023-11-25

3-(difluoromethyl)-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 3-(difluoromethyl)-1-isopropyl-1h-pyrazole-5-carboxylic acid
    • 3-(difluoromethyl)-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid
    • Inchi： 1S/C8H10F2N2O2/c1-4(2)12-6(8(13)14)3-5(11-12)7(9)10/h3-4,7H,1-2H3,(H,13,14)
    • InChI Key： XLMYCOFHQKWHPN-UHFFFAOYSA-N
    • SMILES： FC(C1C=C(C(=O)O)N(C(C)C)N=1)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 223
  • XLogP3: 1.4
  • Topological Polar Surface Area: 55.1

3-(difluoromethyl)-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid Pricemore >>

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