3-[(1-Naphthyloxy)methyl]phenylboronic acid

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Product Information

Molecular Formula
C17H15BO3
Molecular Weight
278.11
Description
May contain varying amounts of anhydride
Synonyms
[3-(naphthalen-1-yloxymethyl)phenyl]boronicacid; 3-[(1-NAPHTHYLOXY)METHYL]PHENYLBORONICACID; 1218790-91-0; ACMC-20anbd; CTK8C5966; AKOS010795512
IUPAC Name
[3-(naphthalen-1-yloxymethyl)phenyl]boronic acid
SMILES
B(C1=CC(=CC=C1)COC2=CC=CC3=CC=CC=C32)(O)O
InChI
InChI=1S/C17H15BO3/c19-18(20)15-8-3-5-13(11-15)12-21-17-10-4-7-14-6-1-2-9-16(14)17/h1-11,19-20H,12H2
InChI Key
SBVPZHOJJDYHHW-UHFFFAOYSA-N
Purity
95%
Appearance
Light brown powder

Safety Information

Hazards
H413

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
4
Exact Mass
278.1114245 g/mol
Monoisotopic Mass
278.1114245 g/mol
Topological Polar Surface Area
49.7Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
323
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2011127933-A1 Bi-functional complexes and methods for making and using such complexes 2010-04-16
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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