Vitas-M small molecule compound

2-(4-iodophenyl)-3a-methyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK252639
SMILES Ic1ccc(cc1)N1C(=O)C2C(C1=O)(C)C1CC2C=C1

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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 C16H14INO2 MW 379.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14INO2/c1-16-10-3-2-9(8-10)13(16)14(19)18(15(16)20)12-6-4-11(17)5-7-12/h2-7,9-10,13H,8H2,1H3
InChIKey
RFKPHBPWISGQRV-UHFFFAOYSA-N
Synonyms

(3AR4S7S7AS)2(4IODOPHENYL)3AMETHYL3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
2(4IODOPHENYL)3AMETHYL3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
CC12C3CC(C1C(=O)N(C2=O)C4=CC=C(C=C4)I)C=C3
InChI=1SC16H14INO2c11610329(810)13(16)14(19)18(15(16)20)126411(17)5712h2791013H8H21H3
MFCD02319309
ZINC000100809917
ZINC000101867546

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Available files

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