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Home > Boronic Acids > 1229584-22-8
1229584-22-8 | 2,5-Difluoro-4-hydroxyphenylboronic acid
CAS No: 1229584-22-8 Catalog No: AG009YLR MDL No:MFCD18394881
Product Description
Catalog Number:
AG009YLR
Chemical Name:
2,5-Difluoro-4-hydroxyphenylboronic acid
CAS Number:
1229584-22-8
Molecular Formula:
C6H5BF2O3
Molecular Weight:
173.9099
MDL Number:
MFCD18394881
IUPAC Name:
(2,5-difluoro-4-hydroxyphenyl)boronic acid
InChI:
InChI=1S/C6H5BF2O3/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2,10-12H
InChI Key:
BKSUWYUPEDFFDX-UHFFFAOYSA-N
SMILES:
OB(c1cc(F)c(cc1F)O)O
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.03g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
173.91g/mol
Monoisotopic Mass:
174.03g/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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