CAS
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Specification
The molecular formula is C8H7ClO2.
The molecular weight is 170.59 g/mol.
It was created on July 19, 2005.
It was last modified on November 25, 2023.
The IUPAC name is 5-chloro-2-hydroxy-4-methylbenzaldehyde.
The InChI is InChI=1S/C8H7ClO2/c1-5-2-8(11)6(4-10)3-7(5)9/h2-4,11H,1H3.
The InChIKey is TVDVRKLTHSTZTH-UHFFFAOYSA-N.
The canonical SMILES is CC1=CC(=C(C=C1Cl)C=O)O.
The CAS number is 3328-68-5.
Yes, it is a canonicalized compound.