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Home > Boronic Acids > 870459-91-9
870459-91-9 | (4-Chloropyridin-2-yl);boronic acid
CAS No: 870459-91-9 Catalog No: AG004NJ1 MDL No:MFCD12401036
Product Description
Catalog Number:
AG004NJ1
Chemical Name:
(4-Chloropyridin-2-yl);boronic acid
CAS Number:
870459-91-9
Molecular Formula:
C5H5BClNO2
Molecular Weight:
157.3627
MDL Number:
MFCD12401036
IUPAC Name:
(4-chloropyridin-2-yl)boronic acid
InChI:
InChI=1S/C5H5BClNO2/c7-4-1-2-8-5(3-4)6(9)10/h1-3,9-10H
InChI Key:
KOLVACJGJSSBEM-UHFFFAOYSA-N
SMILES:
OB(c1nccc(c1)Cl)O
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.01g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.36g/mol
Monoisotopic Mass:
157.01g/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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