Vitas-M small molecule compound

ethyl 4-[2-(4-ethylphenyl)-2-oxo-1-phenylethyl]-5,5-dimethyl-2-oxotetrahydrofuran-3-carboxylate

Catalog ID
STK687362
SMILES CCOC(=O)C1C(=O)OC(C1C(C(=O)c1ccc(cc1)CC)c1ccccc1)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C25H28O5 MW 408.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28O5/c1-5-16-12-14-18(15-13-16)22(26)19(17-10-8-7-9-11-17)21-20(23(27)29-6-2)24(28)30-25(21,3)4/h7-15,19-21H,5-6H2,1-4H3
InChIKey
ZZSGJMVMYPKJIV-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)C(=O)C(C2C(C(=O)OC2(C)C)C(=O)OCC)C3=CC=CC=C3
ETHYL4(2(4ETHYLPHENYL)2OXO1PHENYLETHYL)55DIMETHYL2OXOOXOLANE3CARBOXYLATE
ETHYL4(2(4ETHYLPHENYL)2OXO1PHENYLETHYL)55DIMETHYL2OXOTETRAHYDROFURAN3CARBOXYLATE
InChI=1SC25H28O5c1516121418(151316)22(26)19(17108791117)2120(23(27)2962)24(28)3025(213)4h7151921H56H214H3
MFCD06618465
ZINC000004751456
ZINC000004751459

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.