Cas no 1072952-09-0 (3-Carboxy-2-fluorophenylboronic acid)

3-Carboxy-2-fluorophenylboronic acid structure
1072952-09-0 structure
Product Name:3-Carboxy-2-fluorophenylboronic acid
CAS No:1072952-09-0
MF:C7H6BFO4
MW:183.929545879364
MDL:MFCD03095128
CID:827960
Update Time:2025-04-19

3-Carboxy-2-fluorophenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Carboxy-2-fluorophenylboronic acid
    • 3-Borono-2-fluorobenzoic acid
    • 2-Fluoro-3-carboxyphenylboronic acid
    • MDL: MFCD03095128
    • Inchi: 1S/C7H6BFO4/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3,12-13H,(H,10,11)
    • InChI Key: DLSFOCMCMFDBOG-UHFFFAOYSA-N
    • SMILES: FC1C(C(=O)O)=CC=CC=1B(O)O

Computed Properties

  • Exact Mass: 184.03400
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2

Experimental Properties

  • Density: 1.49±0.1 g/cm3 (20 oC 760 Torr),
  • Solubility: Slightly soluble (9.2 g/l) (25 o C),
  • PSA: 77.76000
  • LogP: -0.79630

3-Carboxy-2-fluorophenylboronic acid Pricemore >>

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