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Home > Boronic Acids > 1254697-46-5
1254697-46-5 | 3H-Imidazo[4,5-b]pyridine, 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1254697-46-5 Catalog No: AG000NPJ MDL No:MFCD16996014
Product Description
Catalog Number:
AG000NPJ
Chemical Name:
3H-Imidazo[4,5-b]pyridine, 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1254697-46-5
Molecular Formula:
C12H16BN3O2
Molecular Weight:
245.0853
MDL Number:
MFCD16996014
IUPAC Name:
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-imidazo[4,5-b]pyridine
InChI:
InChI=1S/C12H16BN3O2/c1-11(2)12(3,4)18-13(17-11)8-5-9-10(14-6-8)16-7-15-9/h5-7H,1-4H3,(H,14,15,16)
InChI Key:
SHLRAQOAGBAHHO-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cnc2c(c1)nc[nH]2
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.134g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.089g/mol
Monoisotopic Mass:
245.134g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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