CAS
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Specification
The molecular formula is C11H11FO4.
The molecular weight is 226.20 g/mol.
The IUPAC name is ethyl 2-(3-fluoro-4-methoxyphenyl)-2-oxoacetate.
The InChI is InChI=1S/C11H11FO4/c1-3-16-11(14)10(13)7-4-5-9(15-2)8(12)6-7/h4-6H,3H2,1-2H3.
The InChIKey is MKCWXEZQXVQTTN-UHFFFAOYSA-N.
The canonical SMILES is CCOC(=O)C(=O)C1=CC(=C(C=C1)OC)F.
The CAS number is 345-72-2.
The EC number is 675-316-0.
The XLogP3-AA value is 2.1.
Yes, it is canonicalized.