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Home > Boronic Acids > 957198-28-6
957198-28-6 | 3-Chloro-2-(4-morpholino)pyridine-4-boronic acid pinacol ester
CAS No: 957198-28-6 Catalog No: AG005YD4 MDL No:MFCD07781227
Product Description
Catalog Number:
AG005YD4
Chemical Name:
3-Chloro-2-(4-morpholino)pyridine-4-boronic acid pinacol ester
CAS Number:
957198-28-6
Molecular Formula:
C15H22BClN2O3
Molecular Weight:
324.6108
MDL Number:
MFCD07781227
IUPAC Name:
4-[3-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]morpholine
InChI:
InChI=1S/C15H22BClN2O3/c1-14(2)15(3,4)22-16(21-14)11-5-6-18-13(12(11)17)19-7-9-20-10-8-19/h5-6H,7-10H2,1-4H3
InChI Key:
ALVOSNAIBGPIGV-UHFFFAOYSA-N
SMILES:
Clc1c(nccc1B1OC(C(O1)(C)C)(C)C)N1CCOCC1
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.141g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.612g/mol
Monoisotopic Mass:
324.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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