Vitas-M small molecule compound
1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl acetate
Catalog ID
STK058876
SMILES CCC(c1cc2OCCOc2cc1[N+](=O)[O-])OC(=O)C
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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 C13H15NO6 MW 281.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15NO6/c1-3-11(20-8(2)15)9-6-12-13(19-5-4-18-12)7-10(9)14(16)17/h6-7,11H,3-5H2,1-2H3InChIKey
NVRQCSAIOZHSQA-UHFFFAOYSA-NSynonyms
444076-41-91(6NITRO23DIHYDRO14BENZODIOXIN7YL)PROPYLACETATE
1(7NITRO23DIHYDRO14BENZODIOXIN6YL)PROPYLACETATE
444076419
ACETICACID1(7NITRO23DIHYDROBENZO(14)DIOXIN6YL)PROPYLESTER
CCC(C1=CC2=C(C=C1(N+)(=O)(O))OCCO2)OC(=O)C
CCC(c1cc2OCCOc2cc1(N+)(=O)(O))OC(=O)C
InChI=1SC13H15NO6c1311(208(2)15)961213(19541812)710(9)14(16)17h6711H35H212H3
MFCD03196387
STK058876
ZINC000004537324
ZINC000004537325
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