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6-cyanonaphthalen-2-ylboronic acid

6-cyanonaphthalen-2-ylboronic acid

Formula: C11H8BNO2

SMILES: OB(O)C1=CC2=CC=C(C=C2C=C1)C#N

IUPAC: (6-cyanonaphthalen-2-yl)boronic acid

InChI: InChI=1S/C11H8BNO2/c13-7-8-1-2-10-6-11(12(14)15)4-3-9(10)5-8/h1-6,14-15H

Composition: C (67.07%), H (4.09%), B (5.49%), N (7.11%), O (16.24%)

Molar Mass: 197

Atom Count: 23

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 197.064809
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey BTCZGAYUQAAPLI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.78
Topological Polar Surface Area 64.25
Polarizability 22.9
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime Formula UnitPrice
98% <10 Days C11H8BNO2 Quote Only