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Home > Boronic Acids > 1379466-84-8
1379466-84-8 | 3,4-Difluoro-5-hydroxyphenylboronic acid
CAS No: 1379466-84-8 Catalog No: AG009WUM MDL No:MFCD22414421
Product Description
Catalog Number:
AG009WUM
Chemical Name:
3,4-Difluoro-5-hydroxyphenylboronic acid
CAS Number:
1379466-84-8
Molecular Formula:
C6H5BF2O3
Molecular Weight:
173.9099
MDL Number:
MFCD22414421
IUPAC Name:
(3,4-difluoro-5-hydroxyphenyl)boronic acid
InChI:
InChI=1S/C6H5BF2O3/c8-4-1-3(7(11)12)2-5(10)6(4)9/h1-2,10-12H
InChI Key:
MSOVFNUAYVHDBC-UHFFFAOYSA-N
SMILES:
OB(c1cc(O)c(c(c1)F)F)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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