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2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

CAS: 1204333-58-3

Formula: C11H14BF2NO2

SMILES: CC1(C)OB(OC1(C)C)C1=CC(F)=NC(F)=C1

IUPAC: 2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

InChI: InChI=1S/C11H14BF2NO2/c1-10(2)11(3,4)17-12(16-10)7-5-8(13)15-9(14)6-7/h5-6H,1-4H3

Composition: C (54.81%), H (5.85%), B (4.48%), F (15.76%), N (5.81%), O (13.27%)

Molar Mass: 241.04

Atom Count: 31

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 241.108565
Formal Charge 0
FSP3 0.55
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey FUGGRIAHIVRPNM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.02
Topological Polar Surface Area 31.35
Polarizability 22.53
Ring Count 2
Rotatable Bond Count 1

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