91591-70-7 Purity
96%
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Specification
The molecular formula of 2-Chloro-4,6-dimethylpyridine-3-carboxaldehyde is C8H8ClNO.
It was created on 2006-10-26 and last modified on 2023-12-30.
The IUPAC name is 2-chloro-4,6-dimethylpyridine-3-carbaldehyde.
The InChI is InChI=1S/C8H8ClNO/c1-5-3-6(2)10-8(9)7(5)4-11/h3-4H,1-2H3.
The InChIKey is KDBVHERPAPVWHV-UHFFFAOYSA-N.
The Canonical SMILES is CC1=CC(=NC(=C1C=O)Cl)C.
The molecular weight is 169.61 g/mol.
It has 2 hydrogen bond acceptor counts.
The topological polar surface area is 30 Ų.
Yes, the compound is canonicalized according to PubChem.