Vitas-M small molecule compound
2-(5-chloro-2-methylphenyl)-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STK727595
SMILES OCC12C=CC(O1)C1C2C(=O)N(C1=O)c1cc(Cl)ccc1C
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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 C16H14ClNO4 MW 319.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO4/c1-8-2-3-9(17)6-10(8)18-14(20)12-11-4-5-16(7-19,22-11)13(12)15(18)21/h2-6,11-13,19H,7H2,1H3InChIKey
ABVBOYDDLJKDFV-UHFFFAOYSA-NSynonyms
2(5chloro2methylphenyl)4(hydroxymethyl)3a477atetrahydro1H47epoxyisoindole13(2H)dione
2(5chloro2methylphenyl)7(hydroxymethyl)47adihydro3aHoctahydro1H47epoxyisoindole13dione
CC1=C(C=C(C=C1)Cl)N2C(=O)C3C4C=CC(C3C2=O)(O4)CO
InChI=1SC16H14ClNO4c18239(17)610(8)1814(20)12114516(7192211)13(12)15(18)21h26111319H7H21H3
MFCD01572297
ZINC000101359616
ZINC000243885747
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