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Home > Boronic Acids > 1006876-23-8
1006876-23-8 | 6-(Dimethylcarbamoyl)pyridin-3-ylboronic acid
CAS No: 1006876-23-8 Catalog No: AG00H9AI MDL No:MFCD08458479
Product Description
Catalog Number:
AG00H9AI
Chemical Name:
6-(Dimethylcarbamoyl)pyridin-3-ylboronic acid
CAS Number:
1006876-23-8
Molecular Formula:
C8H11BN2O3
Molecular Weight:
193.9955
MDL Number:
MFCD08458479
IUPAC Name:
[6-(dimethylcarbamoyl)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C8H11BN2O3/c1-11(2)8(12)7-4-3-6(5-10-7)9(13)14/h3-5,13-14H,1-2H3
InChI Key:
HMQGEHKXJDINOL-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1ccc(cn1)B(O)O)C
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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