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Home > Boronic Acids > 374790-99-5
374790-99-5 | 4-BROMO-2,3-DIFLUOROBENZENEBORONIC ACID
CAS No: 374790-99-5 Catalog No: AG00C0NN MDL No:MFCD02093065
Product Description
Catalog Number:
AG00C0NN
Chemical Name:
4-BROMO-2,3-DIFLUOROBENZENEBORONIC ACID
CAS Number:
374790-99-5
Molecular Formula:
C6H4BBrF2O2
Molecular Weight:
236.8066
MDL Number:
MFCD02093065
IUPAC Name:
(4-bromo-2,3-difluorophenyl)boronic acid
InChI:
InChI=1S/C6H4BBrF2O2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2,11-12H
InChI Key:
CUTKSWXGYLUSCY-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1F)F)Br)O
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.946g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.807g/mol
Monoisotopic Mass:
235.946g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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