Vitas-M small molecule compound

1,4-diethyl-2,3,5-trinitrobenzene

Catalog ID
STL289919
SMILES CCc1c(cc(c(c1[N+](=O)[O-])[N+](=O)[O-])CC)[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 C10H11N3O6 MW 269.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11N3O6/c1-3-6-5-8(11(14)15)7(4-2)10(13(18)19)9(6)12(16)17/h5H,3-4H2,1-2H3
InChIKey
KOMATHOIISNIHJ-UHFFFAOYSA-N
Synonyms
1363844-94-3
1363844943
14diethyl235trinitrobenzene
CCC1=CC(=C(C(=C1(N+)(=O)(O))(N+)(=O)(O))CC)(N+)(=O)(O)
CCc1c(cc(c(c1(N+)(=O)(O))(N+)(=O)(O))CC)(N+)(=O)(O)
InChI=1SC10H11N3O6c13658(11(14)15)7(42)10(13(18)19)9(6)12(16)17h5H34H212H3
MFCD21601734
ZINC000100269844
ZINC100269844

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Available files

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