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Home > Boronic Acids > 1220696-58-1
1220696-58-1 | 3-(difluoromethyl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CAS No: 1220696-58-1 Catalog No: AG01BC8C MDL No:MFCD18733447
Product Description
Catalog Number:
AG01BC8C
Chemical Name:
3-(difluoromethyl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CAS Number:
1220696-58-1
Molecular Formula:
C12H16BF2NO2
Molecular Weight:
255.0687
MDL Number:
MFCD18733447
IUPAC Name:
3-(difluoromethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C12H16BF2NO2/c1-11(2)12(3,4)18-13(17-11)9-5-8(10(14)15)6-16-7-9/h5-7,10H,1-4H3
InChI Key:
RDERAJSLRZKDAV-UHFFFAOYSA-N
SMILES:
FC(c1cncc(c1)B1OC(C(O1)(C)C)(C)C)F
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.124g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.072g/mol
Monoisotopic Mass:
255.124g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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