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Home > Boronic Acids > 871329-82-7
871329-82-7 | (3-Fluoro-5-hydroxyphenyl);boronic acid
CAS No: 871329-82-7 Catalog No: AG004KMA MDL No:MFCD07363778
Product Description
Catalog Number:
AG004KMA
Chemical Name:
(3-Fluoro-5-hydroxyphenyl);boronic acid
CAS Number:
871329-82-7
Molecular Formula:
C6H6BFO3
Molecular Weight:
155.9194
MDL Number:
MFCD07363778
IUPAC Name:
(3-fluoro-5-hydroxyphenyl)boronic acid
InChI:
InChI=1S/C6H6BFO3/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,9-11H
InChI Key:
RMBFBZIEXCTPDB-UHFFFAOYSA-N
SMILES:
Oc1cc(F)cc(c1)B(O)O
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.039g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
155.919g/mol
Monoisotopic Mass:
156.039g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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