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

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

CAS: 1171891-07-8

Formula: C17H20BNO2

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

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

InChI: InChI=1S/C17H20BNO2/c1-16(2)17(3,4)21-18(20-16)15-10-14(11-19-12-15)13-8-6-5-7-9-13/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 NWFQXEHKPNULNY-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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95% <7 Days 1171891-07-8 $37.26-$161.46$37.26$62.10$161.46
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