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Home > Boronic Acids > 1010101-08-2
1010101-08-2 | 2,6-Dichloro-3-methylpyridine-4-boronic acid pinacol ester
CAS No: 1010101-08-2 Catalog No: AG00H9EE MDL No:MFCD11617878
Product Description
Catalog Number:
AG00H9EE
Chemical Name:
2,6-Dichloro-3-methylpyridine-4-boronic acid pinacol ester
CAS Number:
1010101-08-2
Molecular Formula:
C12H16BCl2NO2
Molecular Weight:
287.9779
MDL Number:
MFCD11617878
IUPAC Name:
2,6-dichloro-3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C12H16BCl2NO2/c1-7-8(6-9(14)16-10(7)15)13-17-11(2,3)12(4,5)18-13/h6H,1-5H3
InChI Key:
DKKHFBMUYZBBJF-UHFFFAOYSA-N
SMILES:
Clc1nc(Cl)c(c(c1)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.065g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.975g/mol
Monoisotopic Mass:
287.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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