Vitas-M small molecule compound

4-propanoylphenyl 3,5-dinitrobenzoate

Catalog ID
STK391166
SMILES CCC(=O)c1ccc(cc1)OC(=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 C16H12N2O7 MW 344.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O7/c1-2-15(19)10-3-5-14(6-4-10)25-16(20)11-7-12(17(21)22)9-13(8-11)18(23)24/h3-9H,2H2,1H3
InChIKey
LJJODYNCTLRTTF-UHFFFAOYSA-N
Synonyms
447438-58-6
(4PROPANOYLPHENYL)35DINITROBENZOATE
447438586
4propanoylphenyl35dinitrobenzoate
CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
CCC(=O)c1ccc(cc1)OC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H12N2O7c1215(19)103514(6410)2516(20)11712(17(21)22)913(811)18(23)24h39H2H21H3
MFCD00381989
ZINC000001313690
ZINC01313690
ZINC1313690

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Available files

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