Cas no 731002-59-8 (2-chloro-4-(trifluoromethyl)pyridin-3-ol)

2-Chloro-4-(trifluoromethyl)pyridin-3-ol is a fluorinated pyridine derivative with significant utility in pharmaceutical and agrochemical synthesis. Its trifluoromethyl and chloro substituents enhance reactivity, making it a versatile intermediate for constructing complex heterocyclic frameworks. The hydroxyl group at the 3-position allows for further functionalization, enabling precise modifications in target molecules. This compound exhibits favorable stability under standard conditions, facilitating handling and storage. Its structural features contribute to improved bioavailability and metabolic resistance in derived compounds, making it valuable for developing bioactive agents. The electron-withdrawing effects of the trifluoromethyl group also influence regioselectivity in subsequent reactions, enhancing synthetic efficiency.
2-chloro-4-(trifluoromethyl)pyridin-3-ol structure
731002-59-8 structure
Product Name:2-chloro-4-(trifluoromethyl)pyridin-3-ol
CAS No:731002-59-8
MF:C6H3ClF3NO
MW:197.542330980301
MDL:MFCD16610506
CID:2101857
PubChem ID:72212902
Update Time:2025-05-28

2-chloro-4-(trifluoromethyl)pyridin-3-ol Chemical and Physical Properties

Names and Identifiers

    • 3-Pyridinol, 2-chloro-4-(trifluoromethyl)-
    • 2-chloro-4-(trifluoromethyl)pyridin-3-ol
    • 731002-59-8
    • P19569
    • MFCD16610506
    • 2-CHLORO-3-HYDROXY-4-(TRIFLUOROMETHYL)PYRIDINE
    • AS-79652
    • CS-0185348
    • SY246887
    • AB71213
    • MDL: MFCD16610506
    • Inchi: 1S/C6H3ClF3NO/c7-5-4(12)3(1-2-11-5)6(8,9)10/h1-2,12H
    • InChI Key: FWUISHIPDMLMDO-UHFFFAOYSA-N
    • SMILES: ClC1C(=C(C=CN=1)C(F)(F)F)O

Computed Properties

  • Exact Mass: 196.9855259g/mol
  • Monoisotopic Mass: 196.9855259g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 163
  • 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: 2.3
  • Topological Polar Surface Area: 33.1?2

2-chloro-4-(trifluoromethyl)pyridin-3-ol Pricemore >>

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