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Home > Boronic Acids > 1083168-91-5
1083168-91-5 | 3-CHLORO-2-METHOXYPYRIDINE-5-BORONIC ACID PINACOL ESTER
CAS No: 1083168-91-5 Catalog No: AG008SWM MDL No:MFCD08063054
Product Description
Catalog Number:
AG008SWM
Chemical Name:
3-CHLORO-2-METHOXYPYRIDINE-5-BORONIC ACID PINACOL ESTER
CAS Number:
1083168-91-5
Molecular Formula:
C12H17BClNO3
Molecular Weight:
269.5323
MDL Number:
MFCD08063054
IUPAC Name:
3-chloro-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C12H17BClNO3/c1-11(2)12(3,4)18-13(17-11)8-6-9(14)10(16-5)15-7-8/h6-7H,1-5H3
InChI Key:
ZHWIZWNYOSGXSR-UHFFFAOYSA-N
SMILES:
COc1ncc(cc1Cl)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.532g/mol
Monoisotopic Mass:
269.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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