Vitas-M small molecule compound
(2E)-3-[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]prop-2-enoic acid
Catalog ID
STK398156
SMILES CCOC(=O)COc1ccc(cc1/C=C/C(=O)O)Br
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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 C13H13BrO5 MW 329.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13BrO5/c1-2-18-13(17)8-19-11-5-4-10(14)7-9(11)3-6-12(15)16/h3-7H,2,8H2,1H3,(H,15,16)/b6-3+InChIKey
XTGVULDSOWPACF-ZZXKWVIFSA-NSynonyms
832674-21-2(2E)3(5bromo2(2ethoxy2oxoethoxy)phenyl)prop2enoicacid
(E)3(5bromo2(2ethoxy2oxoethoxy)phenyl)prop2enoicacid
832674212
CCOC(=O)COC1=C(C=C(C=C1)Br)C=CC(=O)O
CCOC(=O)COc1ccc(cc1C=CC(=O)O)Br
InChI=1SC13H13BrO5c121813(17)819115410(14)79(11)3612(15)16h37H28H21H3(H1516)b63+
MFCD02257421
ZINC000002767039
ZINC2767039
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