Methyl 2-chloro-5-fluoro-6-methoxynicotinate

• CAS: 959616-64-9
• Catalog Number: ACM959616649
• Category: Pyridines
• Molecular Weight: 219.56
• Molecular Formula: C8H7ClFNO3
• Synonyms: Methyl 2-chloro-5-fluoro-6-methoxypyridine-3-carboxylate
• Melting Point: 66-68 °C

Custom Q&A

What is the IUPAC name of the compound represented by PubChem CID 40148026?

The IUPAC name is methyl 2-chloro-5-fluoro-6-methoxypyridine-3-carboxylate.

What is the molecular formula of the compound?

The molecular formula is C8H7ClFNO3.

What is the molecular weight of the compound?

The molecular weight is 219.60 g/mol.

What is the InChI code for the compound?

The InChI code is InChI=1S/C8H7ClFNO3/c1-13-7-5(10)3-4(6(9)11-7)8(12)14-2/h3H,1-2H3.

What is the InChIKey of the compound?

The InChIKey is KGWMUWXJNVKKCF-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is COC1=C(C=C(C(=N1)Cl)C(=O)OC)F.

What is the CAS number of the compound?

The CAS number is 959616-64-9.

How many hydrogen bond acceptors are present in the compound?

There are 5 hydrogen bond acceptors present in the compound.

How many rotatable bond counts are there in the compound?

There are 3 rotatable bond counts in the compound.

Is the compound canonicalized according to PubChem?

Yes, the compound is canonicalized according to PubChem.