Vitas-M small molecule compound
2-(2-chloro-6-fluorobenzyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
Catalog ID
STK686964
SMILES OC(=O)C1C2C=CC3(C1C(=O)N(C3)Cc1c(F)cccc1Cl)O2
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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 C16H13ClFNO4 MW 337.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClFNO4/c17-9-2-1-3-10(18)8(9)6-19-7-16-5-4-11(23-16)12(15(21)22)13(16)14(19)20/h1-5,11-13H,6-7H2,(H,21,22)InChIKey
SOIQCTCZLBBALQ-UHFFFAOYSA-NSynonyms
2(2chloro6fluorobenzyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylicacid
C1C23C=CC(O2)C(C3C(=O)N1CC4=C(C=CC=C4Cl)F)C(=O)O
InChI=1SC16H13ClFNO4c17921310(18)8(9)6197165411(2316)12(15(21)22)13(16)14(19)20h151113H67H2(H2122)
MFCD07369052
ZINC000100018729
ZINC000239412328
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