(E)-(3-Methoxystyryl)boronic Acid Pinacol Ester

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Molecular Formula:

C15H21O3B

Molecular Weight:

260.14

CAS Number:

871125-68-7

Catalog Number:

871125-68-7

Product Information

Molecular Formula:

C15H21O3B

Molecular Weight:

260.14

Description

(E)-(3-Methoxystyryl)boronic Acid Pinacol Ester (CAS# 871125-68-7 ) is a useful research chemical.

Synonyms

2-[(E)-2-(3-methoxyphenyl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-[(E)-2-(3-methoxyphenyl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

IUPAC Name

2-[(E)-2-(3-methoxyphenyl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C=CC2=CC(=CC=C2)OC

InChI

InChI=1S/C15H21BO3/c1-14(2)15(3,4)19-16(18-14)10-9-12-7-6-8-13(11-12)17-5/h6-11H,1-5H3/b10-9+

InChI Key

MYKJZXRWDIWMDR-MDZDMXLPSA-N

Boiling Point

313.5 °C at 760 mmHg

Melting Point

36-42 °C (lit.)

Flash Point

230.0 °F - closed cup

Purity

96 %

Density

1.02 g/cm³

LogP

3.33980

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

260.1583747 g/mol

Monoisotopic Mass

260.1583747 g/mol

Topological Polar Surface Area

27.7Å²

Heavy Atom Count

Formal Charge

Complexity

322

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

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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(E)-(3-Methoxystyryl)boronic Acid Pinacol Ester

Product Information

Computed Properties

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