Vitas-M small molecule compound

5-(2-methoxyphenyl)cyclohexane-1,3-dione

Catalog ID
STK415800
SMILES COc1ccccc1C1CC(=O)CC(=O)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 C13H14O3 MW 218.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14O3/c1-16-13-5-3-2-4-12(13)9-6-10(14)8-11(15)7-9/h2-5,9H,6-8H2,1H3
InChIKey
KDFGJXOGEXWKQI-UHFFFAOYSA-N
Synonyms
55579-77-6
5(2METHOXYPHENYL)13CYCLOHEXANEDIONE
5(2methoxyphenyl)cyclohexane13dione
55579776
COC1=CC=CC=C1C2CC(=O)CC(=O)C2
InChI=1SC13H14O3c11613532412(13)9610(14)811(15)79h259H68H21H3
MFCD03844402
ZINC000100014315
ZINC100014315

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Available files

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