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Home > Boronic Acids > 957062-85-0
957062-85-0 | (4-Bromo-6-chloropyridin-3-yl);boronic acid
CAS No: 957062-85-0 Catalog No: AG003BUS MDL No:MFCD09878338
Product Description
Catalog Number:
AG003BUS
Chemical Name:
(4-Bromo-6-chloropyridin-3-yl);boronic acid
CAS Number:
957062-85-0
Molecular Formula:
C5H4BBrClNO2
Molecular Weight:
236.2588
MDL Number:
MFCD09878338
IUPAC Name:
(4-bromo-6-chloropyridin-3-yl)boronic acid
InChI:
InChI=1S/C5H4BBrClNO2/c7-4-1-5(8)9-2-3(4)6(10)11/h1-2,10-11H
InChI Key:
LFWCFEIUOQWFAY-UHFFFAOYSA-N
SMILES:
OB(c1cnc(cc1Br)Cl)O
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.921g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.256g/mol
Monoisotopic Mass:
234.921g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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