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Home > Boronic Acids > 1073355-12-0
1073355-12-0 | 2-(1,1-Diethoxyethyl)pyridine-3-boronic acid pinacol ester
CAS No: 1073355-12-0 Catalog No: AG007WBH MDL No:MFCD09271781
Product Description
Catalog Number:
AG007WBH
Chemical Name:
2-(1,1-Diethoxyethyl)pyridine-3-boronic acid pinacol ester
CAS Number:
1073355-12-0
Molecular Formula:
C17H28BNO4
Molecular Weight:
321.2195
MDL Number:
MFCD09271781
IUPAC Name:
2-(1,1-diethoxyethyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C17H28BNO4/c1-8-20-17(7,21-9-2)14-13(11-10-12-19-14)18-22-15(3,4)16(5,6)23-18/h10-12H,8-9H2,1-7H3
InChI Key:
LTEVBICFPHEMKW-UHFFFAOYSA-N
SMILES:
CCOC(c1ncccc1B1OC(C(O1)(C)C)(C)C)(OCC)C
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.211g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.224g/mol
Monoisotopic Mass:
321.211g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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