Vitas-M small molecule compound

1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl nitrate

Catalog ID
STK069786
SMILES CCC(c1cc2OCCOc2cc1[N+](=O)[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 C11H12N2O7 MW 284.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N2O7/c1-2-9(20-13(16)17)7-5-10-11(19-4-3-18-10)6-8(7)12(14)15/h5-6,9H,2-4H2,1H3
InChIKey
WFAWVMCQKPCFFF-UHFFFAOYSA-N
Synonyms
443640-11-7
1(6NITRO23DIHYDRO14BENZODIOXIN7YL)PROPYLNITRATE
1(7NITRO23DIHYDRO14BENZODIOXIN6YL)PROPYLNITRATE
443640117
CCC(C1=CC2=C(C=C1(N+)(=O)(O))OCCO2)O(N+)(=O)(O)
CCC(c1cc2OCCOc2cc1(N+)(=O)(O))O(N+)(=O)(O)
InChI=1SC11H12N2O7c129(2013(16)17)751011(19431810)68(7)12(14)15h569H24H21H3
MFCD02601789
STK069786
ZINC000003624125
ZINC000003624127

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Available files

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