Vitas-M small molecule compound

({3-[(4-methylphenyl)carbonyl]-1-benzofuran-5-yl}oxy)acetic acid

Catalog ID
STK526564
SMILES OC(=O)COc1ccc2c(c1)c(co2)C(=O)c1ccc(cc1)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 C18H14O5 MW 310.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14O5/c1-11-2-4-12(5-3-11)18(21)15-9-23-16-7-6-13(8-14(15)16)22-10-17(19)20/h2-9H,10H2,1H3,(H,19,20)
InChIKey
LJKJPOGCAPVQOX-UHFFFAOYSA-N
Synonyms
82039-82-5
((3((4methylphenyl)carbonyl)1benzofuran5yl)oxy)aceticacid
((3(4METHYLBENZOYL)1BENZOFURAN5YL)OXY)ACETICACID
2((3((4METHYLPHENYL)OXOMETHYL)5BENZOFURANYL)OXY)ACETICACID
2((3(4METHYLBENZOYL)1BENZOFURAN5YL)OXY)ACETICACID
2((3(4methylbenzoyl)benzofuran5yl)oxy)aceticacid
2((3(4METHYLPHENYL)CARBONYL1BENZOFURAN5YL)OXY)ETHANOICACID
2(3PTOLUOYLBENZOFURAN5YL)OXYACETICACID
5(HYDROPEROXYACETYL)3(PTOLUOYL)BENZOFURAN
82039825
ACETICACID((3(4METHYLBENZOYL)5BENZOFURANYL)OXY)
BENZOFURAN5(HYDROPEROXYACETYL)3(PTOLUOYL)
CC1=CC=C(C=C1)C(=O)C2=COC3=C2C=C(C=C3)OCC(=O)O
InChI=1SC18H14O5c1112412(5311)18(21)15923167613(814(15)16)221017(19)20h29H10H21H3(H1920)
MFCD01828818
ZINC000000210169
ZINC210169

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.