Vitas-M small molecule compound
5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Catalog ID
STK393460
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)C=C1C(=O)OC(OC1=O)(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 C21H19ClO6 MW 402.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClO6/c1-21(2)27-19(23)16(20(24)28-21)10-14-6-9-17(18(11-14)25-3)26-12-13-4-7-15(22)8-5-13/h4-11H,12H2,1-3H3InChIKey
KIXZGMPHAKIXFY-UHFFFAOYSA-NSynonyms
5((4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLENE)22DIMETHYL13DIOXANE46DIONE
5((4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)22DIMETHYL13DIOXANE46DIONE
5(4((4chlorobenzyl)oxy)3methoxybenzylidene)22dimethyl13dioxane46dione
CC1(OC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC)C(=O)O1)C
InChI=1SC21H19ClO6c121(2)2719(23)16(20(24)2821)10146917(18(1114)253)2612134715(22)8513h411H12H213H3
MFCD02603597
ZINC000001011791
ZINC01011791
ZINC1011791
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