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Home > Boronic Acids > 1246765-27-4
1246765-27-4 | 3-Pyridinecarboxylic acid, 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
CAS No: 1246765-27-4 Catalog No: AG000MLB MDL No:MFCD14585291
Product Description
Catalog Number:
AG000MLB
Chemical Name:
3-Pyridinecarboxylic acid, 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
CAS Number:
1246765-27-4
Molecular Formula:
C14H20BNO5
Molecular Weight:
293.1233
MDL Number:
MFCD14585291
IUPAC Name:
methyl 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylate
InChI:
InChI=1S/C14H20BNO5/c1-13(2)14(3,4)21-15(20-13)10-8-7-9(12(17)19-6)11(16-10)18-5/h7-8H,1-6H3
InChI Key:
PZMUSAMVEKGYRK-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nc1OC)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.143g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.126g/mol
Monoisotopic Mass:
293.143g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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