Vitas-M small molecule compound

methyl 2-(3,5-dimethylphenoxy)propanoate

Catalog ID
STK442548
SMILES COC(=O)C(Oc1cc(C)cc(c1)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 C12H16O3 MW 208.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16O3/c1-8-5-9(2)7-11(6-8)15-10(3)12(13)14-4/h5-7,10H,1-4H3
InChIKey
IJIUJEPORWHICY-UHFFFAOYSA-N
Synonyms
667437-46-9
667437469
CC1=CC(=CC(=C1)OC(C)C(=O)OC)C
InChI=1SC12H16O3c1859(2)711(68)1510(3)12(13)144h5710H14H3
methyl2(35dimethylphenoxy)propanoate
MFCD03900682
ZINC000016958015
ZINC000016958017

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Available files

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