Vitas-M small molecule compound

1,2-dibutoxy-4,5-dinitrobenzene

Catalog ID
STK533883
SMILES CCCCOc1cc([N+](=O)[O-])c(cc1OCCCC)[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 C14H20N2O6 MW 312.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N2O6/c1-3-5-7-21-13-9-11(15(17)18)12(16(19)20)10-14(13)22-8-6-4-2/h9-10H,3-8H2,1-2H3
InChIKey
NETYSAHPGMQPJV-UHFFFAOYSA-N
Synonyms
20367-37-7
12dibutoxy45dinitrobenzene
12DINITRO45DIBUTOXYBENZENE
20367377
CCCCOC1=C(C=C(C(=C1)(N+)(=O)(O))(N+)(=O)(O))OCCCC
CCCCOc1cc((N+)(=O)(O))c(cc1OCCCC)(N+)(=O)(O)
InChI=1SC14H20N2O6c13572113911(15(17)18)12(16(19)20)1014(13)228642h910H38H212H3
MFCD02997639
ZINC000003882231
ZINC03882231
ZINC3882231

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Available files

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