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Vitas-M small molecule compound

1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propan-1-ol

Catalog ID
STK027745
SMILES CCC(c1cc2OCCOc2cc1[N+](=O)[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 C11H13NO5 MW 239.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13NO5/c1-2-9(13)7-5-10-11(17-4-3-16-10)6-8(7)12(14)15/h5-6,9,13H,2-4H2,1H3
InChIKey
DZUGNFDFHOHOMY-UHFFFAOYSA-N
Synonyms
732256-86-9
1(6NITRO23DIHYDRO14BENZODIOXIN7YL)PROPAN1OL
1(7NITRO23DIHYDRO14BENZODIOXIN6YL)PROPAN1OL
732256869
CCC(C1=CC2=C(C=C1(N+)(=O)(O))OCCO2)O
CCC(c1cc2OCCOc2cc1(N+)(=O)(O))O
InChI=1SC11H13NO5c129(13)751011(17431610)68(7)12(14)15h56913H24H21H3
MFCD08050147
STK027745
ZINC000004602362
ZINC000004602365

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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