Vitas-M small molecule compound

methyl 2-(2,3,5-trimethylphenoxy)propanoate

Catalog ID
STK435125
SMILES COC(=O)C(Oc1cc(C)cc(c1C)C)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 C13H18O3 MW 222.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18O3/c1-8-6-9(2)10(3)12(7-8)16-11(4)13(14)15-5/h6-7,11H,1-5H3
InChIKey
KWEIDPGSIAMSON-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C(=C1)OC(C)C(=O)OC)C)C
InChI=1SC13H18O3c1869(2)10(3)12(78)1611(4)13(14)155h6711H15H3
methyl2(235trimethylphenoxy)propanoate
MFCD03943324
ZINC000001459108
ZINC000001459109

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Available files

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