Cas no 1269496-37-8 (3-Fluoro-2-formylbenzoic acid)

3-Fluoro-2-formylbenzoic acid structure
3-Fluoro-2-formylbenzoic acid structure
Product Name:3-Fluoro-2-formylbenzoic acid
CAS No:1269496-37-8
MF:C8H5FO3
MW:168.121906042099
MDL:MFCD18453664
CID:4585121
PubChem ID:20237435
Update Time:2024-03-01

3-Fluoro-2-formylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-fluoro-2-formylbenzoic acid
    • 3-Fluoro-2-formylbenzoic acid
    • MDL: MFCD18453664
    • Inchi: 1S/C8H5FO3/c9-7-3-1-2-5(8(11)12)6(7)4-10/h1-4H,(H,11,12)
    • InChI Key: JJJVNKHHFHSRSN-UHFFFAOYSA-N
    • SMILES: FC1=CC=CC(C(=O)O)=C1C=O

Computed Properties

  • Exact Mass: 168.02227218g/mol
  • Monoisotopic Mass: 168.02227218g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 193
  • 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: 1
  • Topological Polar Surface Area: 54.4

3-Fluoro-2-formylbenzoic acid Pricemore >>

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