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

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

CAS: 1096689-44-9

Formula: C12H18BNO2

SMILES: CC1=NC(=CC=C1)B1OC(C)(C)C(C)(C)O1

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

InChI: InChI=1S/C12H18BNO2/c1-9-7-6-8-10(14-9)13-15-11(2,3)12(4,5)16-13/h6-8H,1-5H3

Composition: C (65.79%), H (8.28%), B (4.93%), N (6.39%), O (14.60%)

Molar Mass: 219.09

Atom Count: 34

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 219.143059
Formal Charge 0
FSP3 0.58
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey CDNAXFHDHVSHSY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.46
Topological Polar Surface Area 31.35
Polarizability 24.87
Ring Count 2
Rotatable Bond Count 1

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