CAS
93805-64-2 Purity
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93805-64-2 Purity
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The molecular formula is C14H18O3.
The molecular weight is 234.29 g/mol.
The IUPAC name is ethyl 3-(4-propan-2-ylphenyl)oxirane-2-carboxylate.
The InChI key is ITNKSNPSUNGFLE-UHFFFAOYSA-N.
The canonical SMILES is CCOC(=O)C1C(O1)C2=CC=C(C=C2)C(C)C.
The CAS number is 93805-69-7.
The EC number is 298-552-2.
The hydrogen bond donor count is 0.
The hydrogen bond acceptor count is 3.
Yes, it is a canonicalized compound.