41638-13-5 Purity
96%
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Specification
The molecular formula is C11H12O4.
The molecular weight is 208.21 g/mol.
The IUPAC name is methyl 3-(4-methoxyphenyl)oxirane-2-carboxylate.
The InChI is InChI=1S/C11H12O4/c1-13-8-5-3-7(4-6-8)9-10(15-9)11(12)14-2/h3-6,9-10H,1-2H3.
The InChIKey is CVZUMGUZDAWOGA-UHFFFAOYSA-N.
The canonical SMILES is COC1=CC=C(C=C1)C2C(O2)C(=O)OC.
The CAS number is 42245-42-1.
The XLogP3-AA value is 1.3.
Methyl 3-(4-methoxyphenyl)oxirane-2-carboxylate has 0 hydrogen bond donor count.
Methyl 3-(4-methoxyphenyl)oxirane-2-carboxylate has 4 hydrogen bond acceptor count.