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Structure

2-Chloro-4-methylpyridine-3-boronicacid

CAS
1029654-29-2
Catalog Number
ACM1029654292
Category
Boro-Amino Acids

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What is the molecular formula of 2-Chloro-4-methylpyridine-3-boronic acid?

The molecular formula is C6H7BClNO2.

What is the molecular weight of 2-Chloro-4-methylpyridine-3-boronic acid?

The molecular weight is 171.39 g/mol.

What is the IUPAC name of 2-Chloro-4-methylpyridine-3-boronic acid?

The IUPAC name is (2-chloro-4-methylpyridin-3-yl)boronic acid.

What is the InChI of 2-Chloro-4-methylpyridine-3-boronic acid?

The InChI is InChI=1S/C6H7BClNO2/c1-4-2-3-9-6(8)5(4)7(10)11/h2-3,10-11H,1H3.

What is the InChIKey of 2-Chloro-4-methylpyridine-3-boronic acid?

The InChIKey is VCGWAHJXFWBCSW-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Chloro-4-methylpyridine-3-boronic acid?

The canonical SMILES is B(C1=C(C=CN=C1Cl)C)(O)O.

Does 2-Chloro-4-methylpyridine-3-boronic acid have any hydrogen bond donor count?

Yes, it has 2 hydrogen bond donor count.

Does 2-Chloro-4-methylpyridine-3-boronic acid have any hydrogen bond acceptor count?

Yes, it has 3 hydrogen bond acceptor count.

How many rotatable bonds does 2-Chloro-4-methylpyridine-3-boronic acid have?

It has 1 rotatable bond.

What is the exact mass of 2-Chloro-4-methylpyridine-3-boronic acid?

The exact mass is 171.0258363 g/mol.

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