3-Chloro-4-isopropoxyphenylboronic acid

CAS

480438-56-0

Catalog Number

ACM480438560

Category

Boronic Acids

Molecular Weight

214.45378

Molecular Formula

C9H12 B Cl O3

MSDS COA Spec Sheet

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Specification

Synonyms

3-Chloro-4-isopropoxyphenylboronic acid, 480438-56-0, 3-Chloro-4-isopropoxybenzeneboronic acid, 3-Chloro-4-(1-methylethyl)oxyphenylboronic acid, PubChem23776, ACMC-1AQXP, AC1MPB8B, SureCN101400, KSC234S1P, 564443_ALDRICH, CTK1D4917, MolPort-000-931-759, ACT11019, ANW-30613, AKOS004114074, AB21457, AG-F-63489, AK-40424, BR-40424, KB-31011

IUPAC Name

(3-chloro-4-propan-2-yloxyphenyl)boronic acid

Canonical SMILES

B(C1=CC(=C(C=C1)OC(C)C)Cl)(O)O

InChI Key

PJBWTULFEPFOEB-UHFFFAOYSA-N

Boiling Point

357.1ºC at 760 mmHg

Melting Point

140-145ºC(lit.)

Flash Point

169.8ºC

Density

1.23g/cm³

Exact Mass

214.05700

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 3-Chloro-4-isopropoxyphenylboronic acid?

The molecular formula of 3-Chloro-4-isopropoxyphenylboronic acid is C9H12BClO3.

What is the synonym for 3-Chloro-4-isopropoxyphenylboronic acid?

One synonym for 3-Chloro-4-isopropoxyphenylboronic acid is 480438-56-0.

When was 3-Chloro-4-isopropoxyphenylboronic acid created?

3-Chloro-4-isopropoxyphenylboronic acid was created on September 8, 2005.

What is the IUPAC name of 3-Chloro-4-isopropoxyphenylboronic acid?

The IUPAC name of 3-Chloro-4-isopropoxyphenylboronic acid is (3-chloro-4-propan-2-yloxyphenyl)boronic acid.

What is the InChI of 3-Chloro-4-isopropoxyphenylboronic acid?

The InChI of 3-Chloro-4-isopropoxyphenylboronic acid is InChI=1S/C9H12BClO3/c1-6(2)14-9-4-3-7(10(12)13)5-8(9)11/h3-6,12-13H,1-2H3.

What is the InChIKey of 3-Chloro-4-isopropoxyphenylboronic acid?

The InChIKey of 3-Chloro-4-isopropoxyphenylboronic acid is PJBWTULFEPFOEB-UHFFFAOYSA-N.

What is the molecular weight of 3-Chloro-4-isopropoxyphenylboronic acid?

The molecular weight of 3-Chloro-4-isopropoxyphenylboronic acid is 214.45 g/mol.

How many hydrogen bond donor counts does 3-Chloro-4-isopropoxyphenylboronic acid have?

3-Chloro-4-isopropoxyphenylboronic acid has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 3-Chloro-4-isopropoxyphenylboronic acid have?

3-Chloro-4-isopropoxyphenylboronic acid has 3 hydrogen bond acceptor counts.

What is the topological polar surface area of 3-Chloro-4-isopropoxyphenylboronic acid?

The topological polar surface area of 3-Chloro-4-isopropoxyphenylboronic acid is 49.7Å².