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Specification
The molecular formula of Ethyl 3,4-dimethylbenzoylformate is C12H14O3.
The synonyms for Ethyl 3,4-dimethylbenzoylformate include ethyl 2-(3,4-dimethylphenyl)-2-oxoacetate and ETHYL3,4-DIMETHYLBENZOYLFORMATE.
The molecular weight of Ethyl 3,4-dimethylbenzoylformate is 206.24 g/mol.
The IUPAC name of Ethyl 3,4-dimethylbenzoylformate is ethyl 2-(3,4-dimethylphenyl)-2-oxoacetate.
The InChI of Ethyl 3,4-dimethylbenzoylformate is InChI=1S/C12H14O3/c1-4-15-12(14)11(13)10-6-5-8(2)9(3)7-10/h5-7H,4H2,1-3H3.
The InChIKey of Ethyl 3,4-dimethylbenzoylformate is DGERUSYBAJJOPC-UHFFFAOYSA-N.
The canonical SMILES of Ethyl 3,4-dimethylbenzoylformate is CCOC(=O)C(=O)C1=CC(=C(C=C1)C)C.
The CAS number of Ethyl 3,4-dimethylbenzoylformate is 80120-32-7.
Yes, Ethyl 3,4-dimethylbenzoylformate is a canonicalized compound.