Cas no 29101-99-3 (Acetic acid,2,2-difluoro-2-methoxy-)

Acetic acid,2,2-difluoro-2-methoxy- structure
29101-99-3 structure
Product Name:Acetic acid,2,2-difluoro-2-methoxy-
CAS No:29101-99-3
MF:C3H4F2O3
MW:126.058868408203
CID:265810
Update Time:2025-07-11

Acetic acid,2,2-difluoro-2-methoxy- Chemical and Physical Properties

Names and Identifiers

    • Acetic acid,2,2-difluoro-2-methoxy-
    • 2-(difluoromethoxy)acetic acid
    • Acetic acid,difluoromethoxy
    • Difluoromethoxyacetic acid
    • Acetic acid, difluoromethoxy-
    • 2,2-difluoro-2-methoxyacetic acid
    • Acetic acid, 2,2-difluoro-2-methoxy-
    • Inchi: 1S/C3H4F2O3/c1-8-3(4,5)2(6)7/h1H3,(H,6,7)
    • InChI Key: KCGCXLSDRPQIHU-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C(F)(F)OC

Computed Properties

  • Exact Mass: 126.01300
  • Monoisotopic Mass: 126.01285
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 3
  • Complexity: 82.6
  • 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
  • Topological Polar Surface Area: 46.5

Experimental Properties

  • Density: 1.395
  • Boiling Point: 197.4°Cat760mmHg
  • Flash Point: 73.2°C
  • Refractive Index: 1.352
  • PSA: 46.53000
  • LogP: 0.31020
  • pka: 0.61±0.10(Predicted)

Acetic acid,2,2-difluoro-2-methoxy- Pricemore >>

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