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Home > Boronic Acids > 913836-08-5
913836-08-5 | 2-Chloro-4-methylpyridine-5-boronic acid
CAS No: 913836-08-5 Catalog No: AG00GSKG MDL No:MFCD07368882
Product Description
Catalog Number:
AG00GSKG
Chemical Name:
2-Chloro-4-methylpyridine-5-boronic acid
CAS Number:
913836-08-5
Molecular Formula:
C6H7BClNO2
Molecular Weight:
171.3893
MDL Number:
MFCD07368882
IUPAC Name:
(6-chloro-4-methylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C6H7BClNO2/c1-4-2-6(8)9-3-5(4)7(10)11/h2-3,10-11H,1H3
InChI Key:
HMDMMWUUIMJRAQ-UHFFFAOYSA-N
SMILES:
OB(c1cnc(cc1C)Cl)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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