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Home > Boronic Acids > 1093115-76-4
1093115-76-4 | 6-(DiethylcarbaMoyl)pyridine-3-boronic acid
CAS No: 1093115-76-4 Catalog No: AG0094ZR MDL No:MFCD08458480
Product Description
Catalog Number:
AG0094ZR
Chemical Name:
6-(DiethylcarbaMoyl)pyridine-3-boronic acid
CAS Number:
1093115-76-4
Molecular Formula:
C10H15BN2O3
Molecular Weight:
222.0487
MDL Number:
MFCD08458480
IUPAC Name:
[6-(diethylcarbamoyl)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C10H15BN2O3/c1-3-13(4-2)10(14)9-6-5-8(7-12-9)11(15)16/h5-7,15-16H,3-4H2,1-2H3
InChI Key:
YTYDHNSBMXYLFK-UHFFFAOYSA-N
SMILES:
CCN(C(=O)c1ccc(cn1)B(O)O)CC
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.118g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.051g/mol
Monoisotopic Mass:
222.118g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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