Vitas-M small molecule compound

2-(4-ethoxyphenyl)-2-oxoethyl 2,4-dinitrobenzoate

Catalog ID
STK204845
SMILES CCOc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=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 C17H14N2O8 MW 374.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O8/c1-2-26-13-6-3-11(4-7-13)16(20)10-27-17(21)14-8-5-12(18(22)23)9-15(14)19(24)25/h3-9H,2,10H2,1H3
InChIKey
YOEJDDLHABSVCT-UHFFFAOYSA-N
Synonyms

(2(4ETHOXYPHENYL)2OXOETHYL)24DINITROBENZOATE
2(4ETHOXYPHENYL)2OXOETHYL24DINITROBENZOATE
CCOC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O)
CCOc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC17H14N2O8c1226136311(4713)16(20)102717(21)148512(18(22)23)915(14)19(24)25h39H210H21H3
MFCD01436361
ZINC000004740695
ZINC04740695
ZINC4740695

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Available files

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