Vitas-M small molecule compound

(2Z)-2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2,2-dimethylpropanoate

Catalog ID
STK992242
SMILES O=C(C(C)(C)C)Oc1ccc2c(c1)O/C(=C\c1c(Cl)cccc1Cl)/C2=O

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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 C20H16Cl2O4 MW 391.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Cl2O4/c1-20(2,3)19(24)25-11-7-8-12-16(9-11)26-17(18(12)23)10-13-14(21)5-4-6-15(13)22/h4-10H,1-3H3/b17-10-
InChIKey
WTDLUEAZNKKYSQ-YVLHZVERSA-N
Synonyms
622824-34-4
((2Z)2((26DICHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)22DIMETHYLPROPANOATE
(2Z)2(26dichlorobenzylidene)3oxo23dihydro1benzofuran6yl22dimethylpropanoate
(Z)2(26dichlorobenzylidene)3oxo23dihydrobenzofuran6ylpivalate
2((26DICHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL22DIMETHYLPROPANOATE
622824344
CC(C)(C)C(=O)OC1=CC2=C(C=C1)C(=O)C(=CC3=C(C=CC=C3Cl)Cl)O2
InChI=1SC20H16Cl2O4c120(23)19(24)2511781216(911)2617(18(12)23)101314(21)54615(13)22h410H13H3b1710
MFCD06295035
O=C(C(C)(C)C)Oc1ccc2c(c1)OC(=Cc1c(Cl)cccc1Cl)C2=O
ZINC000009306628
ZINC09306628
ZINC9306628

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Available files

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