Vitas-M small molecule compound
(2E)-3-{3-bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]phenyl}prop-2-enoic acid
Catalog ID
STL553969
SMILES CCOc1cc(/C=C/C(=O)O)cc(c1OCc1cccc(c1)F)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 C18H16BrFO4 MW 395.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrFO4/c1-2-23-16-10-12(6-7-17(21)22)9-15(19)18(16)24-11-13-4-3-5-14(20)8-13/h3-10H,2,11H2,1H3,(H,21,22)/b7-6+InChIKey
GPVDYRRQKRBQME-VOTSOKGWSA-NSynonyms
(~(E))3(3bromo5ethoxy4((3fluorophenyl)methoxy)phenyl)prop2enoicacid
(2E)3(3bromo5ethoxy4((3fluorobenzyl)oxy)phenyl)prop2enoicacid
135637912
InChI=1SC18H16BrFO4c1223161012(6717(21)22)915(19)18(16)24111343514(20)813h310H211H21H3(H2122)b76+
MFCD31751587
ZINC000324833126
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