Vitas-M small molecule compound
2-[4-(hydroxymethyl)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl]benzonitrile
Catalog ID
STK727596
SMILES N#Cc1ccccc1N1C(=O)C2C(C1=O)C1(OC2C=C1)CO
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C16H12N2O4 MW 296.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O4/c17-7-9-3-1-2-4-10(9)18-14(20)12-11-5-6-16(8-19,22-11)13(12)15(18)21/h1-6,11-13,19H,8H2InChIKey
UNDJPBBSRIWKRJ-UHFFFAOYSA-NSynonyms
2(4(hydroxymethyl)13dioxo133a477ahexahydro2H47epoxyisoindol2yl)benzonitrile
2(7(hydroxymethyl)13dioxo47adihydro3aHoctahydro1H47epoxyisoindol2yl)benzonitrile
C1=CC=C(C(=C1)C#N)N2C(=O)C3C4C=CC(C3C2=O)(O4)CO
InChI=1SC16H12N2O4c1779312410(9)1814(20)12115616(8192211)13(12)15(18)21h16111319H8H2
MFCD01802298
ZINC000101359624
ZINC000101359633
Check stock
See real-time availability and sample size for STK727596 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.