Vitas-M small molecule compound

(2Z)-2-(3-bromobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl furan-2-carboxylate

Catalog ID
STK924129
SMILES Brc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccco1

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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 C20H11BrO5 MW 411.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H11BrO5/c21-13-4-1-3-12(9-13)10-18-19(22)15-7-6-14(11-17(15)26-18)25-20(23)16-5-2-8-24-16/h1-11H/b18-10-
InChIKey
DEBBVFVWDOIFLT-ZDLGFXPLSA-N
Synonyms
622360-85-4
((2Z)2((3BROMOPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)FURAN2CARBOXYLATE
(2Z)2(3bromobenzylidene)3oxo23dihydro1benzofuran6ylfuran2carboxylate
(Z)2(3bromobenzylidene)3oxo23dihydrobenzofuran6ylfuran2carboxylate
2((3BROMOPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLFURAN2CARBOXYLATE
2(3BROMOBENZYLIDENE)3OXO23DIHYDRO1BENZOFURAN6YL2FUROATE
622360854
Brc1cccc(c1)C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1ccco1
C1=CC(=CC(=C1)Br)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CO4
InChI=1SC20H11BrO5c211341312(913)101819(22)157614(1117(15)2618)2520(23)165282416h111Hb1810
MFCD04176339
ZINC000002343699
ZINC02343699
ZINC2343699

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Available files

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