Vitas-M small molecule compound
(2E)-3-{3-chloro-4-[(2-chloro-4-fluorobenzyl)oxy]-5-methoxyphenyl}prop-2-enoic acid
Catalog ID
STL508136
SMILES COc1cc(/C=C/C(=O)O)cc(c1OCc1ccc(cc1Cl)F)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 C17H13Cl2FO4 MW 371.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl2FO4/c1-23-15-7-10(2-5-16(21)22)6-14(19)17(15)24-9-11-3-4-12(20)8-13(11)18/h2-8H,9H2,1H3,(H,21,22)/b5-2+InChIKey
HTQRXJUHQBZRQX-GORDUTHDSA-NSynonyms
(~(E))3(3chloro4((2chloro4fluorophenyl)methoxy)5methoxyphenyl)prop2enoicacid
(2E)3(3CHLORO4((2CHLORO4FLUOROBENZYL)OXY)5METHOXYPHENYL)ACRYLICACID
(2E)3(3chloro4((2chloro4fluorobenzyl)oxy)5methoxyphenyl)prop2enoicacid
91685219
InChI=1SC17H13Cl2FO4c12315710(2516(21)22)614(19)17(15)249113412(20)813(11)18h28H9H21H3(H2122)b52+
MFCD31615272
ZINC000226336725
ZINC226336725
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