Vitas-M small molecule compound

2-{[(2Z)-2-(2-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoic acid

Catalog ID
STK711841
SMILES OC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccccc1Cl)/C2=O)C

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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 C18H13ClO5 MW 344.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClO5/c1-10(18(21)22)23-12-6-7-13-15(9-12)24-16(17(13)20)8-11-4-2-3-5-14(11)19/h2-10H,1H3,(H,21,22)/b16-8-
InChIKey
IDOKVEZBMXGAPF-PXNMLYILSA-N
Synonyms
900260-40-4
(Z)2((2(2chlorobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoicacid
2(((2Z)2((2CHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOICACID
2(((2Z)2(2chlorobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoicacid
2(2((2CHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOICACID
900260404
CC(C(=O)O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CC=C3Cl)O2
InChI=1SC18H13ClO5c110(18(21)22)2312671315(912)2416(17(13)20)811423514(11)19h210H1H3(H2122)b168
MFCD06773234
OC(=O)C(Oc1ccc2c(c1)OC(=Cc1ccccc1Cl)C2=O)C
ZINC000005243580
ZINC000005243584

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Available files

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