4-(naphthalen-1-yl)phenylboronic acid

4-(naphthalen-1-yl)phenylboronic acid

CAS: 870774-25-7

Formula: C16H13BO2

SMILES: OB(O)C1=CC=C(C=C1)C1=CC=CC2=CC=CC=C12

IUPAC: [4-(naphthalen-1-yl)phenyl]boronic acid

InChI: InChI=1S/C16H13BO2/c18-17(19)14-10-8-13(9-11-14)16-7-3-5-12-4-1-2-6-15(12)16/h1-11,18-19H

Composition: C (77.46%), H (5.28%), B (4.36%), O (12.90%)

Molar Mass: 248.09

Atom Count: 32

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	248.10086
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	BQHVXFQXTOIMQM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.19
Topological Polar Surface Area	40.46
Polarizability	32.22
Ring Count	3
Rotatable Bond Count	2

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