4-Acetoxyphenylboronic Acid Pinacol Ester

Inquiry

Molecular Formula:

C14H19O4B

Molecular Weight:

262.11

CAS Number:

480424-70-2

Catalog Number:

480424-70-2

Product Information

Molecular Formula:

C14H19O4B

Molecular Weight:

262.11

Description

4-Acetoxyphenylboronic Acid Pinacol Ester (CAS# 480424-70-2) is a useful research chemical.

Synonyms

acetic acid [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] ester; [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] acetate

IUPAC Name

[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] acetate

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OC(=O)C

InChI

InChI=1S/C14H19BO4/c1-10(16)17-12-8-6-11(7-9-12)15-18-13(2,3)14(4,5)19-15/h6-9H,1-5H3

InChI Key

KHBAJCWEQNVCSN-UHFFFAOYSA-N

Boiling Point

351.9 °C at 760 mmHg

Melting Point

67-71 °C (lit.)

Flash Point

Not applicable

Purity

97 %

Density

1.08 g/cm³

Appearance

Solid

LogP

1.91110

Safety Information

Precautionary Statement

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362

Signal Word

Warning

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

262.1376392 g/mol

Monoisotopic Mass

262.1376392 g/mol

Topological Polar Surface Area

44.8Å²

Heavy Atom Count

Formal Charge

Complexity

329

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-111381458-A	Photoresist cleaning solution	2018-12-27
CN-111381459-A	Photoresist cleaning solution	2018-12-27
TW-201617314-A	Carboxylic acid derivative	2014-09-10
AU-2010280323-A1	Novel compounds as modulators of glucocorticoid receptors	2009-07-31
CA-2769563-A1	Novel compounds as modulators of glucocorticoid receptors	2009-07-31
EP-2459524-A2	Novel compounds as modulators of glucocorticoid receptors	2009-07-31
JP-2013500962-A	Novel compounds as modulators of glucocorticoid receptors	2009-07-31
US-2012220590-A1	Novel compounds as modulators of glucocorticoid receptors	2009-07-31
WO-2011016050-A2	Novel compounds as modulators of glucocorticoid receptors	2009-07-31
US-2012149693-A1	Therapeutic compounds	2009-05-05

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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