Vitas-M small molecule compound

dimethyl 2-[(2-ethylhexanoyl)amino]benzene-1,4-dicarboxylate

Catalog ID
STK416709
SMILES CCCCC(C(=O)Nc1cc(ccc1C(=O)OC)C(=O)OC)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 C18H25NO5 MW 335.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25NO5/c1-5-7-8-12(6-2)16(20)19-15-11-13(17(21)23-3)9-10-14(15)18(22)24-4/h9-12H,5-8H2,1-4H3,(H,19,20)
InChIKey
YNBOHFWDIHPOAK-UHFFFAOYSA-N
Synonyms

CCCCC(CC)C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC
dimethyl2((2ethylhexanoyl)amino)benzene14dicarboxylate
DIMETHYL2((2ETHYLHEXANOYL)AMINO)TEREPHTHALATE
DIMETHYL2(2ETHYLHEXANOYLAMINO)BENZENE14DICARBOXYLATE
InChI=1SC18H25NO5c157812(62)16(20)19151113(17(21)233)91014(15)18(22)244h912H58H214H3(H1920)
METHYL3(2ETHYLHEXANOYLAMINO)4(METHOXYCARBONYL)BENZOATE
MFCD01336622
ZINC000004611405
ZINC000004611408

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Available files

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