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Home > Boronic Acids > 2096340-25-7
2096340-25-7 | 4-[(3-Fluorophenyl)(hydroxy)methyl]phenylboronic acid
CAS No: 2096340-25-7 Catalog No: AG01EHJA MDL No:MFCD22205755
Product Description
Catalog Number:
AG01EHJA
Chemical Name:
4-[(3-Fluorophenyl)(hydroxy)methyl]phenylboronic acid
CAS Number:
2096340-25-7
MDL Number:
MFCD22205755
IUPAC Name:
[4-[(3-fluorophenyl)-hydroxymethyl]phenyl]boronic acid
InChI:
InChI=1S/C13H12BFO3/c15-12-3-1-2-10(8-12)13(16)9-4-6-11(7-5-9)14(17)18/h1-8,13,16-18H
InChI Key:
KQKCINWLQAXWDS-UHFFFAOYSA-N
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.086g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
246.044g/mol
Monoisotopic Mass:
246.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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