6-ethoxynaphthalen-2-ylboronic acid

6-ethoxynaphthalen-2-ylboronic acid

CAS: 352525-98-5

Formula: C12H13BO3

SMILES: CCOC1=CC=C2C=C(C=CC2=C1)B(O)O

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

InChI: InChI=1S/C12H13BO3/c1-2-16-12-6-4-9-7-11(13(14)15)5-3-10(9)8-12/h3-8,14-15H,2H2,1H3

Composition: C (66.71%), H (6.07%), B (5.00%), O (22.22%)

Molar Mass: 216.04

Atom Count: 29

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	216.095774
Formal Charge	0
FSP3	0.17
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	INXXVGFSXYJGHI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.27
Topological Polar Surface Area	49.69
Polarizability	25.43
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	352525-98-5		Quote Only