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Home > Boronic Acids > 697739-22-3

697739-22-3

697739-22-3 | 2-Chloro-6-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

CAS No: 697739-22-3 Catalog No: AG003H0Q MDL No:MFCD08063106

Product Description

Catalog Number:
AG003H0Q
Chemical Name:
2-Chloro-6-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CAS Number:
697739-22-3
Molecular Formula:
C12H17BClNO2
Molecular Weight:
253.5329
MDL Number:
MFCD08063106
IUPAC Name:
2-chloro-6-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C12H17BClNO2/c1-8-6-9(7-10(14)15-8)13-16-11(2,3)12(4,5)17-13/h6-7H,1-5H3
InChI Key:
CDNAAWYZHQPEAX-UHFFFAOYSA-N
SMILES:
Cc1nc(Cl)cc(c1)B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.104g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.533g/mol
Monoisotopic Mass:
253.104g/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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