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Home > Boronic Acids > 1163706-77-1
1163706-77-1 | Pyridine, 2-(1H-imidazol-1-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1163706-77-1 Catalog No: AG000CBI MDL No:MFCD09879119
Product Description
Catalog Number:
AG000CBI
Chemical Name:
Pyridine, 2-(1H-imidazol-1-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1163706-77-1
Molecular Formula:
C14H18BN3O2
Molecular Weight:
271.1226
MDL Number:
MFCD09879119
IUPAC Name:
2-imidazol-1-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C14H18BN3O2/c1-13(2)14(3,4)20-15(19-13)11-6-5-7-12(17-11)18-9-8-16-10-18/h5-10H,1-4H3
InChI Key:
QABHFJLOSGQKKY-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cccc(n1)n1cncc1
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.149g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.127g/mol
Monoisotopic Mass:
271.149g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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