3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine

3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine

CAS: 939430-30-5

Formula: C17H20BNO2

SMILES: CC1(C)OB(OC1(C)C)C1=CC=CC(=C1)C1=CN=CC=C1

IUPAC: 3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine

InChI: InChI=1S/C17H20BNO2/c1-16(2)17(3,4)21-18(20-16)15-9-5-7-13(11-15)14-8-6-10-19-12-14/h5-12H,1-4H3

Composition: C (72.62%), H (7.17%), B (3.84%), N (4.98%), O (11.38%)

Molar Mass: 281.16

Atom Count: 41

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	281.158709
Formal Charge	0
FSP3	0.35
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	KVEIJNJPKCWYQF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.69
Topological Polar Surface Area	31.35
Polarizability	34.12
Ring Count	3
Rotatable Bond Count	2

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