Vitas-M small molecule compound

tetraethyl 2,2'-(3,7-dioxo-3,7-dihydro-1H,5H-benzo[1,2-c:4,5-c']difuran-1,5-diylidene)dipropanedioate

Catalog ID
STK090360
SMILES CCOC(=O)C(=C1OC(=O)c2c1cc1C(=O)OC(=C(C(=O)OCC)C(=O)OCC)c1c2)C(=O)OCC

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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 C24H22O12 MW 502.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22O12/c1-5-31-21(27)15(22(28)32-6-2)17-11-9-14-12(10-13(11)19(25)35-17)18(36-20(14)26)16(23(29)33-7-3)24(30)34-8-4/h9-10H,5-8H2,1-4H3
InChIKey
MZQFFBVTDLZZAH-UHFFFAOYSA-N
Synonyms
332056-19-6
332056196
CCOC(=O)C(=C1C2=CC3=C(C=C2C(=O)O1)C(=C(C(=O)OCC)C(=O)OCC)OC3=O)C(=O)OCC
CCOC(=O)C(=C1OC(=O)c2c1cc1C(=O)OC(=C(C(=O)OCC)C(=O)OCC)c1c2)C(=O)OCC
DIETHYL2(1(13DIETHOXY13DIOXOPROPAN2YLIDENE)37DIOXOFURO(34F)(2)BENZOFURAN5YLIDENE)PROPANEDIOATE
DIETHYL2(5(BIS(ETHOXYCARBONYL)METHYLENE)37DIOXOFURANO(34F)ISOBENZOFURANYLIDENE)PROPANE13DIOATE
InChI=1SC24H22O12c153121(27)15(22(28)3262)171191412(1013(11)19(25)3517)18(3620(14)26)16(23(29)3373)24(30)3484h910H58H214H3
MFCD01542309
STK090360
TETRAETHYL22(37DIOXO37DIHYDRO1H5HBENZO(12C45C)DIFURAN15DIYLIDENE)DIPROPANEDIOATE
tetraethyl22(37dioxobenzo(12c45c)difuran15(3H7H)diylidene)dimalonate
ZINC000009730951
ZINC09730951
ZINC9730951

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Available files

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