Vitas-M small molecule compound

(2Z)-2-(4-bromobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 1,3-benzodioxole-5-carboxylate

Catalog ID
STK992268
SMILES Brc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2

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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 C23H13BrO6 MW 465.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13BrO6/c24-15-4-1-13(2-5-15)9-21-22(25)17-7-6-16(11-19(17)30-21)29-23(26)14-3-8-18-20(10-14)28-12-27-18/h1-11H,12H2/b21-9-
InChIKey
VSGMCBZEJBMKOC-NKVSQWTQSA-N
Synonyms
622801-26-7
((2Z)2((4BROMOPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)13BENZODIOXOLE5CARBOXYLATE
(2Z)2(4bromobenzylidene)3oxo23dihydro1benzofuran6yl13benzodioxole5carboxylate
(Z)2(4bromobenzylidene)3oxo23dihydrobenzofuran6ylbenzo(d)(13)dioxole5carboxylate
2((4BROMOPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL2HBENZO(34D)13DIOXOLENE5CARBOXYLATE
622801267
Brc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2
C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CC=C(C=C5)Br)O4
InChI=1SC23H13BrO6c24154113(2515)92122(25)177616(1119(17)3021)2923(26)14381820(1014)28122718h111H12H2b219
MFCD04154887
ZINC000002400210
ZINC02400210
ZINC2400210

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Available files

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