Vitas-M small molecule compound

2-(3-hydroxyphenyl)-5-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK269642
SMILES CC1=CCC2C(C1)C(=O)N(C2=O)c1cccc(c1)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 C15H15NO3 MW 257.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15NO3/c1-9-5-6-12-13(7-9)15(19)16(14(12)18)10-3-2-4-11(17)8-10/h2-5,8,12-13,17H,6-7H2,1H3
InChIKey
WRHHZKPPAYCKOJ-UHFFFAOYSA-N
Synonyms
201989-55-1
1HISOINDOLE13(2H)DIONE3A477ATETRAHYDRO2(3HYDROXYPHENYL)5METHYL
2(3hydroxyphenyl)5methyl3a477atetrahydro1Hisoindole13(2H)dione
2(3HYDROXYPHENYL)5METHYL3A477ATETRAHYDROISOINDOLE13DIONE
201989551
CC1=CCC2C(C1)C(=O)N(C2=O)C3=CC(=CC=C3)O
InChI=1SC15H15NO3c19561213(79)15(19)16(14(12)18)1032411(17)810h258121317H67H21H3
MFCD00195775
ZINC000017986972
ZINC000100012454

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Available files

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