Vitas-M small molecule compound
2-(ethoxycarbonyl)phenyl 3,5-dinitrobenzoate
Catalog ID
STK444337
SMILES CCOC(=O)c1ccccc1OC(=O)c1cc(cc(c1)[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 C16H12N2O8 MW 360.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O8/c1-2-25-16(20)13-5-3-4-6-14(13)26-15(19)10-7-11(17(21)22)9-12(8-10)18(23)24/h3-9H,2H2,1H3InChIKey
UILLOXZKKVYLMK-UHFFFAOYSA-NSynonyms
(2ETHOXYCARBONYLPHENYL)35DINITROBENZOATE
2(ethoxycarbonyl)phenyl35dinitrobenzoate
35DINITROBENZOICACID2ETHOXYCARBONYLPHENYLESTER
CCOC(=O)C1=CC=CC=C1OC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
CCOC(=O)c1ccccc1OC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H12N2O8c122516(20)13534614(13)2615(19)10711(17(21)22)912(810)18(23)24h39H2H21H3
MFCD01076987
ZINC000004712983
ZINC04712983
ZINC4712983
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