Vitas-M small molecule compound
2-(3-chloro-2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STL445231
SMILES O=C1C2C3C=CC(C2C(=O)N1c1cccc(c1C)Cl)C3
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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 C16H14ClNO2 MW 287.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO2/c1-8-11(17)3-2-4-12(8)18-15(19)13-9-5-6-10(7-9)14(13)16(18)20/h2-6,9-10,13-14H,7H2,1H3InChIKey
JJMFSUFCMMLJSG-UHFFFAOYSA-NSynonyms
2(3chloro2methylphenyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC1=C(C=CC=C1Cl)N2C(=O)C3C4CC(C3C2=O)C=C4
InChI=1SC16H14ClNO2c1811(17)32412(8)1815(19)1395610(79)14(13)16(18)20h269101314H7H21H3
MFCD00860251
ZINC000102734640
ZINC000247826574
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