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Home > Boronic Acids > 1320397-15-6
1320397-15-6 | Boronic acid, B-(2-chloro-6-methyl-4-pyridinyl)-
CAS No: 1320397-15-6 Catalog No: AG001034 MDL No:MFCD13188704
Product Description
Catalog Number:
AG001034
Chemical Name:
Boronic acid, B-(2-chloro-6-methyl-4-pyridinyl)-
CAS Number:
1320397-15-6
Molecular Formula:
C6H7BClNO2
Molecular Weight:
171.3893
MDL Number:
MFCD13188704
IUPAC Name:
(2-chloro-6-methylpyridin-4-yl)boronic acid
InChI:
InChI=1S/C6H7BClNO2/c1-4-2-5(7(10)11)3-6(8)9-4/h2-3,10-11H,1H3
InChI Key:
OUDHMBLTDQMBOV-UHFFFAOYSA-N
SMILES:
Cc1nc(Cl)cc(c1)B(O)O
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.026g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
171.387g/mol
Monoisotopic Mass:
171.026g/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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