Vitas-M small molecule compound

3-(2,5-dioxopyrrolidin-1-yl)-4-methylbenzoic acid

Catalog ID
STK255535
SMILES O=C1CCC(=O)N1c1cc(ccc1C)C(=O)O

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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 C12H11NO4 MW 233.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11NO4/c1-7-2-3-8(12(16)17)6-9(7)13-10(14)4-5-11(13)15/h2-3,6H,4-5H2,1H3,(H,16,17)
InChIKey
DXWXNJRVULDSKE-UHFFFAOYSA-N
Synonyms
107947-16-0
107947160
3(25dioxopyrrolidin1yl)4methylbenzoicacid
CC1=C(C=C(C=C1)C(=O)O)N2C(=O)CCC2=O
InChI=1SC12H11NO4c17238(12(16)17)69(7)1310(14)4511(13)15h236H45H21H3(H1617)
MFCD01576758
ZINC000000187394
ZINC187394

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Available files

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