Vitas-M small molecule compound
(2E)-3-{3-chloro-5-ethoxy-4-[(2-fluorobenzyl)oxy]phenyl}prop-2-enoic acid
Catalog ID
STL570164
SMILES CCOc1cc(/C=C/C(=O)O)cc(c1OCc1ccccc1F)Cl
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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 C18H16ClFO4 MW 350.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClFO4/c1-2-23-16-10-12(7-8-17(21)22)9-14(19)18(16)24-11-13-5-3-4-6-15(13)20/h3-10H,2,11H2,1H3,(H,21,22)/b8-7+InChIKey
QRKJHJYHCWNTQQ-BQYQJAHWSA-NSynonyms
(2E)3(3chloro5ethoxy4((2fluorobenzyl)oxy)phenyl)prop2enoicacid
(E)3(3chloro5ethoxy4((2fluorophenyl)methoxy)phenyl)prop2enoicacid
6250270
InChI=1SC18H16ClFO4c1223161012(7817(21)22)914(19)18(16)241113534615(13)20h310H211H21H3(H2122)b87+
MFCD09718717
ZINC000011801182
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