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Home > Boronic Acids > 458532-96-2
458532-96-2 | 2-Chloro-4-pyridylboronic acid
CAS No: 458532-96-2 Catalog No: AG003383 MDL No:MFCD03788416
Product Description
Catalog Number:
AG003383
Chemical Name:
2-Chloro-4-pyridylboronic acid
CAS Number:
458532-96-2
Molecular Formula:
C5H5BClNO2
Molecular Weight:
157.3627
MDL Number:
MFCD03788416
IUPAC Name:
(2-chloropyridin-4-yl)boronic acid
InChI:
InChI=1S/C5H5BClNO2/c7-5-3-4(6(9)10)1-2-8-5/h1-3,9-10H
InChI Key:
WJYRVVDXJMJLTN-UHFFFAOYSA-N
SMILES:
Clc1nccc(c1)B(O)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
Literature
| Title | Journal |
|---|---|
| Design, synthesis, and characterization of a highly effective Hog1 inhibitor: a powerful tool for analyzing MAP kinase signaling in yeast. | PloS one 20110101 |
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