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

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

CAS: 2152673-80-6

Formula: C25H28BNO4

SMILES: CC1(C)OB(OC1(C)C)C1=C(OCC2=CC=CC=C2)N=C(OCC2=CC=CC=C2)C=C1

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

InChI: InChI=1S/C25H28BNO4/c1-24(2)25(3,4)31-26(30-24)21-15-16-22(28-17-19-11-7-5-8-12-19)27-23(21)29-18-20-13-9-6-10-14-20/h5-16H,17-18H2,1-4H3

Composition: C (71.95%), H (6.76%), B (2.59%), N (3.36%), O (15.34%)

Molar Mass: 417.31

Atom Count: 59

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	417.211138
Formal Charge	0
FSP3	0.32
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	WPHHXAQXUQVEHH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	116.33
Topological Polar Surface Area	49.81
Polarizability	47.34
Ring Count	4
Rotatable Bond Count	7

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