Vitas-M small molecule compound

2-(3-acetylphenyl)-4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK269638
SMILES O=C1N(c2cccc(c2)C(=O)C)C(=O)C2C1C1(Cl)C(=C(C2(C1(Cl)Cl)Cl)Cl)Cl

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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 C17H9Cl6NO3 MW 487.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9Cl6NO3/c1-6(25)7-3-2-4-8(5-7)24-13(26)9-10(14(24)27)16(21)12(19)11(18)15(9,20)17(16,22)23/h2-5,9-10H,1H3
InChIKey
XQWZRJUKGZLZJA-UHFFFAOYSA-N
Synonyms

2(3acetylphenyl)456788hexachloro3a477atetrahydro1H47methanoisoindole13(2H)dione
CC(=O)C1=CC(=CC=C1)N2C(=O)C3C(C2=O)C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl
InChI=1SC17H9Cl6NO3c16(25)73248(57)2413(26)910(14(24)27)16(21)12(19)11(18)15(920)17(1622)23h25910H1H3
MFCD02619958
ZINC000169618831
ZINC000169618833

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Available files

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