Vitas-M small molecule compound

3-ethoxy-4-(propan-2-yloxy)benzoic acid

Catalog ID
STK425813
SMILES CCOc1cc(ccc1OC(C)C)C(=O)O

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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 C12H16O4 MW 224.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16O4/c1-4-15-11-7-9(12(13)14)5-6-10(11)16-8(2)3/h5-8H,4H2,1-3H3,(H,13,14)
InChIKey
JFDSVALOUSIPSC-UHFFFAOYSA-N
Synonyms
52009-54-8
3ETHOXY4(METHYLETHOXY)BENZOICACID
3ethoxy4(propan2yloxy)benzoicacid
3ETHOXY4ISOPROPOXYBENZOICACID
3ETHOXY4PROPAN2YLOXYBENZOICACID
52009548
CCOC1=C(C=CC(=C1)C(=O)O)OC(C)C
InChI=1SC12H16O4c14151179(12(13)14)5610(11)168(2)3h58H4H213H3(H1314)
MFCD01922115
ZINC000001476181
ZINC1476181

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Available files

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