Vitas-M small molecule compound

4-(4-methoxy-2,3,6-trimethylphenyl)butan-2-one

Catalog ID
STK370737
SMILES COc1cc(C)c(c(c1C)C)CCC(=O)C

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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 C14H20O2 MW 220.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20O2/c1-9-8-14(16-5)12(4)11(3)13(9)7-6-10(2)15/h8H,6-7H2,1-5H3
InChIKey
QLRCMNNRVMXTDH-UHFFFAOYSA-N
Synonyms
57399-32-3
2BUTANONE4(4METHOXY236TRIMETHYLPHENYL)
4(4methoxy236trimethylphenyl)butan2one
57399323
CC1=CC(=C(C(=C1CCC(=O)C)C)C)OC
InChI=1SC14H20O2c19814(165)12(4)11(3)13(9)7610(2)15h8H67H215H3
MFCD00449198
ZINC000003160878
ZINC03160878
ZINC3160878

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Available files

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