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

The molecular formula is C7H8BClO2.

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

The molecular weight is 170.40 g/mol.

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

The IUPAC name is (3-chloro-4-methylphenyl)boronic acid.

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

The InChI is InChI=1S/C7H8BClO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,10-11H,1H3.

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

The InChIKey is YTJUYWRCAZWVSX-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Chloro-4-methylphenylboronic acid?

The canonical SMILES is B(C1=CC(=C(C=C1)C)Cl)(O)O.

What is the ChEMBL ID of 3-Chloro-4-methylphenylboronic acid?

The ChEMBL ID is CHEMBL4540708.

Is 3-Chloro-4-methylphenylboronic acid a canonicalized compound?

Yes, it is a canonicalized compound.

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3-Chloro-4-methylphenylboronic acid

Name: 3-Chloro-4-methylphenylboronic acid
SKU: ACM175883633
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Catalog NumberACM175883633

CAS Number175883-63-3

CategorySalt

Synonyms

3-CHLORO-4-METHYLPHENYLBORONIC ACID;3-CHLORO-4-METHYLBENZENEBORONIC ACID;AKOS BRN-0174;3-Chloro-4-Methylphenylboronic;3-CHLORO-4-METHYLPHENYLBORONIC ACID 96%;3-Chloro-4-methylboronic acid;3-Chloro-p-tolylboronic acid;3-Chloro-4-methylphenylboronic acid ,9

IUPAC Name

(3-chloro-4-methylphenyl)boronic acid

Molecular Weight

170.4g/mol

Molecular Formula

C7H8BClO2

Canonical SMILES

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

InChI

InChI=1S/C7H8BClO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,10-11H,1H3

InChI Key

YTJUYWRCAZWVSX-UHFFFAOYSA-N