Cas no 375369-29-2 (2,4,5-trifluoromandelic acid)

2,4,5-trifluoromandelic acid structure
2,4,5-trifluoromandelic acid structure
Product Name:2,4,5-trifluoromandelic acid
CAS No:375369-29-2
MF:C8H5F3O3
MW:206.118713140488
CID:922383
PubChem ID:44139266
Update Time:2025-04-19

2,4,5-trifluoromandelic acid Chemical and Physical Properties

Names and Identifiers

    • 2,4,5-trifluoromandelic acid
    • 2,4,5-Trifluorobenzotrifluoride
    • Benzene,1,2,4-trifluoro-5-(trifluoromethyl)
    • Z1269165997
    • 2-hydroxy-2-(2,4,5-trifluorophenyl)acetic acid
    • AKOS034181914
    • SCHEMBL5085545
    • CS-0256202
    • 2,4,5-TRIFLUOROMANDELICACID
    • 375369-29-2
    • EN300-1704245
    • Inchi: 1S/C8H5F3O3/c9-4-2-6(11)5(10)1-3(4)7(12)8(13)14/h1-2,7,12H,(H,13,14)
    • InChI Key: KGSNZRPLTBOIQG-UHFFFAOYSA-N
    • SMILES: FC1C=C(C(=CC=1C(C(=O)O)O)F)F

Computed Properties

  • Exact Mass: 206.01900
  • Monoisotopic Mass: 206.01907850g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 224
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 57.5?2

Experimental Properties

  • PSA: 57.53000
  • LogP: 1.22190

2,4,5-trifluoromandelic acid Pricemore >>

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