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Home > Boronic Acids > 1454558-46-3
1454558-46-3 | 1-Methyl-2-oxopyridine-3-boronic acid
CAS No: 1454558-46-3 Catalog No: AG00HXFB MDL No:MFCD23699496
Product Description
Catalog Number:
AG00HXFB
Chemical Name:
1-Methyl-2-oxopyridine-3-boronic acid
CAS Number:
1454558-46-3
Molecular Formula:
C6H8BNO3
Molecular Weight:
152.9436
MDL Number:
MFCD23699496
IUPAC Name:
(1-methyl-2-oxopyridin-3-yl)boronic acid
InChI:
InChI=1S/C6H8BNO3/c1-8-4-2-3-5(6(8)9)7(10)11/h2-4,10-11H,1H3
InChI Key:
IPAHLTCMITXOQM-UHFFFAOYSA-N
SMILES:
OB(c1cccn(c1=O)C)O
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.06g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
152.944g/mol
Monoisotopic Mass:
153.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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