CAS
90886-53-6 Purity
96%
90886-53-6 Purity
96%
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Specification
The molecular formula is C7H9NO3.
The IUPAC name is ethyl 4-methyl-1,3-oxazole-2-carboxylate.
The InChIKey is BURJGDDAPYCFGM-UHFFFAOYSA-N.
The Canonical SMILES is CCOC(=O)C1=NC(=CO1)C.
The exact mass is 155.058243149 g/mol.
There are 4 hydrogen bond acceptors.
There are 3 rotatable bond counts.
The topological polar surface area is 52.3 Å^2.
Yes, the compound is canonicalized.
The complexity of the compound is 149.