Vitas-M small molecule compound

5-methyl-2-[4-(trifluoromethoxy)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK771887
SMILES CC1=CCC2C(C1)C(=O)N(C2=O)c1ccc(cc1)OC(F)(F)F

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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 C16H14F3NO3 MW 325.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3NO3/c1-9-2-7-12-13(8-9)15(22)20(14(12)21)10-3-5-11(6-4-10)23-16(17,18)19/h2-6,12-13H,7-8H2,1H3
InChIKey
GUCMWUWXRSMXNW-UHFFFAOYSA-N
Synonyms

5methyl2(4(trifluoromethoxy)phenyl)3a477atetrahydro1Hisoindole13(2H)dione
5METHYL2(4(TRIFLUOROMETHOXY)PHENYL)3A477ATETRAHYDROISOINDOLE13DIONE
CC1=CCC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC(F)(F)F
InChI=1SC16H14F3NO3c19271213(89)15(22)20(14(12)21)103511(6410)2316(1718)19h261213H78H21H3
MFCD03767757
ZINC000000106235
ZINC000097960647

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Available files

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