Vitas-M small molecule compound
1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propan-1-one
Catalog ID
STK029378
SMILES CCC(=O)c1cc2OCCOc2cc1[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 C11H11NO5 MW 237.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11NO5/c1-2-9(13)7-5-10-11(17-4-3-16-10)6-8(7)12(14)15/h5-6H,2-4H2,1H3InChIKey
OZIQYDPFZXTZSB-UHFFFAOYSA-NSynonyms
1(6NITRO23DIHYDRO14BENZODIOXIN7YL)PROPAN1ONE
1(7NITRO23DIHYDRO14BENZODIOXIN6YL)PROPAN1ONE
1(7NITRO2H3HBENZO(34E)14DIOXAN6YL)PROPAN1ONE
CCC(=O)C1=CC2=C(C=C1(N+)(=O)(O))OCCO2
CCC(=O)c1cc2OCCOc2cc1(N+)(=O)(O)
InChI=1SC11H11NO5c129(13)751011(17431610)68(7)12(14)15h56H24H21H3
MFCD01070796
STK029378
ZINC000004141592
ZINC04141592
ZINC4141592
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