4-Chloro-3-methoxyphenylboronic acid pinacol ester

CAS

627525-96-6

Catalog Number

ACM627525966

Category

Other Products; Boronic Esters

Molecular Weight

268.5

Molecular Formula

C₁₃H₁₈BClO₃

MSDS COA Spec Sheet

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Specification

Synonyms

627525-96-6, 2-(4-chloro-3-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 4-Chloro-3-methoxyphenylboronic acid pinacol ester, SureCN858457, CTK8B6287, ANW-53218, AKOS015960323, RL04387, AK-94510, BD231418, KB-14771, A833971, 2-(4-chloranyl-3-methoxy-phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

IUPAC Name

2-(4-chloro-3-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Canonical SMILES

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

InChI Key

MPAOYOWXKCYTSJ-UHFFFAOYSA-N

Exact Mass

268.10400

H-Bond Acceptor

H-Bond Donor

May 23, 2023

High efficient synthesis of probe molecules.
The molecule synthesized by 4-Chloro-3-methoxyphenylboronic acid pinacol ester and quinoline can detect hydrogen peroxide efficiently.

What is the molecular formula of the compound?

The molecular formula of the compound is C13H18BClO3.

What is the molecular weight of the compound?

The molecular weight of the compound is 268.54 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 2-(4-chloro-3-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C13H18BClO3/c1-12(2)13(3,4)18-14(17-12)9-6-7-10(15)11(8-9)16-5/h6-8H,1-5H3.

What is the InChIKey of the compound?

The InChIKey of the compound is MPAOYOWXKCYTSJ-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2)Cl)OC.