Cas no 1246633-54-4 (2-Fluoro-6-(hydroxymethyl)phenylboronic acid)

2-Fluoro-6-(hydroxymethyl)phenylboronic acid structure
1246633-54-4 structure
Product Name:2-Fluoro-6-(hydroxymethyl)phenylboronic acid
CAS No:1246633-54-4
MF:C7H8BFO3
MW:169.946025848389
MDL:MFCD18383507
CID:1024598
PubChem ID:53216581
Update Time:2025-07-31

2-Fluoro-6-(hydroxymethyl)phenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (2-Fluoro-6-(hydroxymethyl)phenyl)boronic acid
    • [2-fluoro-6-(hydroxymethyl)phenyl]boronic acid
    • 1246633-54-4
    • Boronic acid, B-[2-fluoro-6-(hydroxymethyl)phenyl]-
    • DB-141369
    • 2-FLUORO-6-(HYDROXYMETHYL)PHENYLBORONIC ACID
    • BS-19634
    • 2-Fluoro-6-(hydroxymethyl)phenylboronic acid(contains varying amounts of Anhydride)
    • DTXSID10681743
    • (2-Fluoro-6-(hydroxymethyl)phenyl)boronicacid
    • SY030172
    • MFCD18383507
    • CS-0101907
    • D76241
    • A890399
    • AKOS015893148
    • WZB63354
    • B-[2-fluoro-6-(hydroxymethyl)phenyl]boronic acid
    • 2-Fluoro-6-(hydroxymethyl)phenylboronic acid
    • MDL: MFCD18383507
    • Inchi: 1S/C7H8BFO3/c9-6-3-1-2-5(4-10)7(6)8(11)12/h1-3,10-12H,4H2
    • InChI Key: CITKAVQBGQMNCG-UHFFFAOYSA-N
    • SMILES: FC1=CC=CC(CO)=C1B(O)O

Computed Properties

  • Exact Mass: 170.05500
  • Monoisotopic Mass: 170.0550524g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 145
  • 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: 60.7?2

Experimental Properties

  • PSA: 60.69000
  • LogP: -1.00220

2-Fluoro-6-(hydroxymethyl)phenylboronic acid Pricemore >>

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