Vitas-M small molecule compound

2-(2,4-dinitrophenoxy)-3,5,7-trimethylcyclohepta-2,4,6-trien-1-one

Catalog ID
STK529876
SMILES Cc1cc(C)c(c(=O)c(c1)C)Oc1ccc(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 C16H14N2O6 MW 330.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O6/c1-9-6-10(2)15(19)16(11(3)7-9)24-14-5-4-12(17(20)21)8-13(14)18(22)23/h4-8H,1-3H3
InChIKey
SLDXYJPWNJXBRN-UHFFFAOYSA-N
Synonyms
63507-76-6
2(24dinitrophenoxy)357trimethylcyclohepta246trien1one
2(24dinitrophenoxy)357trimethylcyclohepta246trienone
63507766
CC1=CC(=C(C(=O)C(=C1)C)OC2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O))C
Cc1cc(C)c(c(=O)c(c1)C)Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H14N2O6c19610(2)15(19)16(11(3)79)24145412(17(20)21)813(14)18(22)23h48H13H3
MFCD01854349
ZINC000001309479
ZINC01309479
ZINC1309479

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Available files

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