Vitas-M small molecule compound
2-ethoxy-3,5-dinitrobenzonitrile
Catalog ID
STK377461
SMILES CCOc1c(C#N)cc(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 C9H7N3O5 MW 237.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7N3O5/c1-2-17-9-6(5-10)3-7(11(13)14)4-8(9)12(15)16/h3-4H,2H2,1H3InChIKey
YHGJVIFBXCFQRM-UHFFFAOYSA-NSynonyms
2ETHOXY35DINITROBENZENECARBONITRILE
2ethoxy35dinitrobenzonitrile
CCOC1=C(C=C(C=C1C#N)(N+)(=O)(O))(N+)(=O)(O)
CCOc1c(C#N)cc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC9H7N3O5c121796(510)37(11(13)14)48(9)12(15)16h34H2H21H3
MFCD01529631
ZINC000004181864
ZINC04181864
ZINC4181864
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