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Specification
The molecular formula of the compound is C8H6ClFO2.
The synonyms for the compound are 4-chloro-2-fluoro-5-methoxybenzaldehyde, 177034-24-1, and Benzaldehyde, 4-chloro-2-fluoro-5-methoxy-.
The molecular weight of the compound is 188.58 g/mol.
The IUPAC name of the compound is 4-chloro-2-fluoro-5-methoxybenzaldehyde.
The InChI of the compound is InChI=1S/C8H6ClFO2/c1-12-8-2-5(4-11)7(10)3-6(8)9/h2-4H,1H3.
The InChIKey of the compound is XWPDQEBSWPVPKG-UHFFFAOYSA-N.
The canonical SMILES of the compound is COC1=C(C=C(C(=C1)C=O)F)Cl.
The CAS number of the compound is 177034-24-1.
The European Community (EC) number of the compound is 676-165-3.
Yes, the compound is canonicalized.