Vitas-M small molecule compound
dimethyl [1-(4-chlorophenyl)-2-methyl-3-(4-methylphenyl)-3-oxopropyl]propanedioate
Catalog ID
STK684434
SMILES COC(=O)C(C(C(C(=O)c1ccc(cc1)C)C)c1ccc(cc1)Cl)C(=O)OC
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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 C22H23ClO5 MW 402.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClO5/c1-13-5-7-16(8-6-13)20(24)14(2)18(15-9-11-17(23)12-10-15)19(21(25)27-3)22(26)28-4/h5-12,14,18-19H,1-4H3InChIKey
AGZBEALVOQHHPK-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)C(C)C(C2=CC=C(C=C2)Cl)C(C(=O)OC)C(=O)OC
dimethyl(1(4chlorophenyl)2methyl3(4methylphenyl)3oxopropyl)propanedioate
DIMETHYL2(1(4CHLOROPHENYL)2METHYL3(4METHYLPHENYL)3OXOPROPYL)PROPANEDIOATE
InChI=1SC22H23ClO5c1135716(8613)20(24)14(2)18(1591117(23)121015)19(21(25)273)22(26)284h512141819H14H3
MFCD05854448
ZINC000004694047
ZINC000004694051
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