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Home > Boronic Acids > 1256355-30-2
1256355-30-2 | Boronic acid, B-(5-fluoro-2-formylphenyl)-
CAS No: 1256355-30-2 Catalog No: AG000O3E MDL No:MFCD09953731
Product Description
Catalog Number:
AG000O3E
Chemical Name:
Boronic acid, B-(5-fluoro-2-formylphenyl)-
CAS Number:
1256355-30-2
Molecular Formula:
C7H6BFO3
Molecular Weight:
167.9301
MDL Number:
MFCD09953731
IUPAC Name:
(5-fluoro-2-formylphenyl)boronic acid
InChI:
InChI=1S/C7H6BFO3/c9-6-2-1-5(4-10)7(3-6)8(11)12/h1-4,11-12H
InChI Key:
FLYQNYPIYYNUCW-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1B(O)O)F
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.039g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.93g/mol
Monoisotopic Mass:
168.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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