Vitas-M small molecule compound

3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl furan-2-carboxylate

Catalog ID
STK922762
SMILES Brc1ccc(cc1)c1c(C)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 C21H13BrO5 MW 425.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrO5/c1-12-19(13-4-6-14(22)7-5-13)20(23)16-9-8-15(11-18(16)26-12)27-21(24)17-3-2-10-25-17/h2-11H,1H3
InChIKey
OSIHTIBJAFJQDC-UHFFFAOYSA-N
Synonyms
610752-48-2
(3(4BROMOPHENYL)2METHYL4OXOCHROMEN7YL)FURAN2CARBOXYLATE
3(4bromophenyl)2methyl4oxo4Hchromen7ylfuran2carboxylate
3(4BROMOPHENYL)2METHYL4OXOCHROMEN7YLFURAN2CARBOXYLATE
610752482
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=CO3)C4=CC=C(C=C4)Br
InChI=1SC21H13BrO5c11219(134614(22)7513)20(23)169815(1118(16)2612)2721(24)1732102517h211H1H3
MFCD04166654
ZINC000001097530
ZINC01097530
ZINC1097530

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Available files

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