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Home > Boronic Acids > 1443112-26-2
1443112-26-2 | 5-(Dimethylcarbamoyl)pyridine-3-boronic acid
CAS No: 1443112-26-2 Catalog No: AG018PUN MDL No:MFCD12911850
Product Description
Catalog Number:
AG018PUN
Chemical Name:
5-(Dimethylcarbamoyl)pyridine-3-boronic acid
CAS Number:
1443112-26-2
Molecular Formula:
C8H11BN2O3
Molecular Weight:
193.9955
MDL Number:
MFCD12911850
IUPAC Name:
[5-(dimethylcarbamoyl)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C8H11BN2O3/c1-11(2)8(12)6-3-7(9(13)14)5-10-4-6/h3-5,13-14H,1-2H3
InChI Key:
VBABYPOKPONQAR-UHFFFAOYSA-N
SMILES:
OB(c1cncc(c1)C(=O)N(C)C)O
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.086g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.997g/mol
Monoisotopic Mass:
194.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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