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1201644-42-9

1201644-42-9 | N,N-diMethyl-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)nicotinaMide

CAS No: 1201644-42-9 Catalog No: AG009570 MDL No:MFCD11878276

Product Description

Catalog Number:
AG009570
Chemical Name:
N,N-diMethyl-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)nicotinaMide
CAS Number:
1201644-42-9
Molecular Formula:
C14H21BN2O3
Molecular Weight:
276.1391
MDL Number:
MFCD11878276
IUPAC Name:
N,N-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide
InChI:
InChI=1S/C14H21BN2O3/c1-13(2)14(3,4)20-15(19-13)11-7-10(8-16-9-11)12(18)17(5)6/h7-9H,1-6H3
InChI Key:
ZUFJKKGQYIZCPE-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1cncc(c1)B1OC(C(O1)(C)C)(C)C)C

Properties

Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.165g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.143g/mol
Monoisotopic Mass:
276.165g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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