Vitas-M small molecule compound

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

Catalog ID
STK268203
SMILES O=C1C2CC=CCC2C(=O)N1c1cc(Cl)ccc1O

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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 C14H12ClNO3 MW 277.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClNO3/c15-8-5-6-12(17)11(7-8)16-13(18)9-3-1-2-4-10(9)14(16)19/h1-2,5-7,9-10,17H,3-4H2
InChIKey
NZAXFEBXRNNIOD-UHFFFAOYSA-N
Synonyms

2(5chloro2hydroxyphenyl)3a477atetrahydro1Hisoindole13(2H)dione
2(5CHLORO2HYDROXYPHENYL)3A477ATETRAHYDROISOINDOLE13DIONE
C1C=CCC2C1C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)O
InChI=1SC14H12ClNO3c1585612(17)11(78)1613(18)9312410(9)14(16)19h125791017H34H2
MFCD01062888
ZINC000017975834
ZINC000100509624

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Available files

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