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Home > Boronic Acids > 1015242-42-8
1015242-42-8 | 6-((1-Methylpiperidin-4-yl)oxy)pyridine-3-boronic acid pinacol ester
CAS No: 1015242-42-8 Catalog No: AG00H9HJ MDL No:MFCD13191363
Product Description
Catalog Number:
AG00H9HJ
Chemical Name:
6-((1-Methylpiperidin-4-yl)oxy)pyridine-3-boronic acid pinacol ester
CAS Number:
1015242-42-8
Molecular Formula:
C17H27BN2O3
Molecular Weight:
318.2189
MDL Number:
MFCD13191363
IUPAC Name:
2-(1-methylpiperidin-4-yl)oxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C17H27BN2O3/c1-16(2)17(3,4)23-18(22-16)13-6-7-15(19-12-13)21-14-8-10-20(5)11-9-14/h6-7,12,14H,8-11H2,1-5H3
InChI Key:
UUPDXVPALBXDQH-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)Oc1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.211g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.224g/mol
Monoisotopic Mass:
318.211g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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