Vitas-M small molecule compound

3,5-bis(propan-2-yloxy)benzoic acid

Catalog ID
STL388004
SMILES CC(Oc1cc(OC(C)C)cc(c1)C(=O)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 C13H18O4 MW 238.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18O4/c1-8(2)16-11-5-10(13(14)15)6-12(7-11)17-9(3)4/h5-9H,1-4H3,(H,14,15)
InChIKey
JDJUEYKZTTWEOB-UHFFFAOYSA-N
Synonyms
150242-82-3
35bis(propan2yloxy)benzoicacid
35di(propan2yloxy)benzoicacid
35DIISOPROPOXYBENZOICACID
CC(C)OC1=CC(=CC(=C1)C(=O)O)OC(C)C
Registry IDs
MFCD00086528
ZINC000019908882
ZINC19908882

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Available files

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