Vitas-M small molecule compound
5-[(2-ethylhexyl)oxy]benzene-1,3-dicarboxylic acid
Catalog ID
STK360625
SMILES CCCCC(COc1cc(cc(c1)C(=O)O)C(=O)O)CC
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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 C16H22O5 MW 294.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22O5/c1-3-5-6-11(4-2)10-21-14-8-12(15(17)18)7-13(9-14)16(19)20/h7-9,11H,3-6,10H2,1-2H3,(H,17,18)(H,19,20)InChIKey
GPCHPCGSBLALBM-UHFFFAOYSA-NSynonyms
221529-32-4221529324
5((2ethylhexyl)oxy)benzene13dicarboxylicacid
5(2ethylhexoxy)benzene13dicarboxylicacid
CCCCC(CC)COC1=CC(=CC(=C1)C(=O)O)C(=O)O
InChI=1SC16H22O5c135611(42)102114812(15(17)18)713(914)16(19)20h7911H3610H212H3(H1718)(H1920)
MFCD11852574
ZINC000020096641
ZINC000020096643
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