Vitas-M small molecule compound
(3E)-4-(4-ethoxyphenyl)-2-oxobut-3-enoic acid
Catalog ID
STL193330
SMILES CCOc1ccc(cc1)/C=C/C(=O)C(=O)O
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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 C12H12O4 MW 220.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12O4/c1-2-16-10-6-3-9(4-7-10)5-8-11(13)12(14)15/h3-8H,2H2,1H3,(H,14,15)/b8-5+InChIKey
HJKMBPVZEOESLB-VMPITWQZSA-NSynonyms
(3E)4(4ethoxyphenyl)2oxobut3enoicacid
(E)4(4ethoxyphenyl)2oxobut3enoicacid
CCOC1=CC=C(C=C1)C=CC(=O)C(=O)O
CCOc1ccc(cc1)C=CC(=O)C(=O)O
InChI=1SC12H12O4c121610639(4710)5811(13)12(14)15h38H2H21H3(H1415)b85+
MFCD19370724
ZINC000057951357
ZINC57951357
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