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Home > Boronic Acids > 536693-95-5
536693-95-5 | 2-CHLORO-6-METHYLPYRIDINE-3-BORONIC ACID
CAS No: 536693-95-5 Catalog No: AG00D8EM MDL No:MFCD03411563
Product Description
Catalog Number:
AG00D8EM
Chemical Name:
2-CHLORO-6-METHYLPYRIDINE-3-BORONIC ACID
CAS Number:
536693-95-5
Molecular Formula:
C6H7BClNO2
Molecular Weight:
171.3893
MDL Number:
MFCD03411563
IUPAC Name:
(2-chloro-6-methylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C6H7BClNO2/c1-4-2-3-5(7(10)11)6(8)9-4/h2-3,10-11H,1H3
InChI Key:
ANQOEORPINPUEB-UHFFFAOYSA-N
SMILES:
OB(c1ccc(nc1Cl)C)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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