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Structure

3-Chloro-5-fluoroisonicotinic acid

CAS
514798-03-9
Catalog Number
ACM514798039
Category
Pyridines
Molecular Weight
175.5
Molecular Formula
C6H3ClFNO2

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Specification

Synonyms
3-Chloro-5-fluoro-pyridine-4-carboxylic Acid
What is the molecular formula of 3-Chloro-5-fluoroisonicotinic acid?

The molecular formula of 3-Chloro-5-fluoroisonicotinic acid is C6H3ClFNO2.

When was 3-Chloro-5-fluoroisonicotinic acid first created and modified?

3-Chloro-5-fluoroisonicotinic acid was first created on October 26, 2006, and last modified on December 30, 2023.

What is the IUPAC Name of 3-Chloro-5-fluoroisonicotinic acid?

The IUPAC Name of 3-Chloro-5-fluoroisonicotinic acid is 3-chloro-5-fluoropyridine-4-carboxylic acid.

What is the InChIKey of 3-Chloro-5-fluoroisonicotinic acid?

The InChIKey of 3-Chloro-5-fluoroisonicotinic acid is APKYTXKVPCYUOG-UHFFFAOYSA-N.

What is the Canonical SMILES of 3-Chloro-5-fluoroisonicotinic acid?

The Canonical SMILES of 3-Chloro-5-fluoroisonicotinic acid is C1=C(C(=C(C=N1)Cl)C(=O)O)F.

What is the European Community (EC) Number of 3-Chloro-5-fluoroisonicotinic acid?

The European Community (EC) Number of 3-Chloro-5-fluoroisonicotinic acid is 849-885-2.

What is the molecular weight of 3-Chloro-5-fluoroisonicotinic acid?

The molecular weight of 3-Chloro-5-fluoroisonicotinic acid is 175.54 g/mol.

How many hydrogen bond donor counts does 3-Chloro-5-fluoroisonicotinic acid have?

3-Chloro-5-fluoroisonicotinic acid has one hydrogen bond donor count.

What is the topological polar surface area of 3-Chloro-5-fluoroisonicotinic acid?

The topological polar surface area of 3-Chloro-5-fluoroisonicotinic acid is 50.2 Å2.

Is 3-Chloro-5-fluoroisonicotinic acid a canonicalized compound?

Yes, 3-Chloro-5-fluoroisonicotinic acid is a canonicalized compound according to the PubChem data.

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