Cas no 1105995-37-6 (6-(Difluoromethyl)-4-methylnicotinic acid)

6-(Difluoromethyl)-4-methylnicotinic acid structure
1105995-37-6 structure
Product Name:6-(Difluoromethyl)-4-methylnicotinic acid
CAS No:1105995-37-6
MF:C8H7F2NO2
MW:187.143489122391
MDL:MFCD18257243
CID:4784413
Update Time:2023-11-22

6-(Difluoromethyl)-4-methylnicotinic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Pyridinecarboxylic acid, 6-(difluoromethyl)-4-methyl-
    • TQU0385
    • 6-(difluoromethyl)-4-methylnicotinic acid
    • 2-(Difluoromethyl)-4-methylpyridine-5-carboxylic acid
    • 6-(Difluoromethyl)-4-methylnicotinic acid
    • MDL: MFCD18257243
    • Inchi: 1S/C8H7F2NO2/c1-4-2-6(7(9)10)11-3-5(4)8(12)13/h2-3,7H,1H3,(H,12,13)
    • InChI Key: QQBRHCKOIGDFQL-UHFFFAOYSA-N
    • SMILES: FC(C1C=C(C)C(C(=O)O)=CN=1)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 199
  • XLogP3: 1.4
  • Topological Polar Surface Area: 50.2

6-(Difluoromethyl)-4-methylnicotinic acid Pricemore >>

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