Vitas-M small molecule compound

6-nitro-7-(prop-2-en-1-yl)-2,3-dihydro-1,4-benzodioxine

Catalog ID
STL282502
SMILES C=CCc1cc2OCCOc2cc1[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 C11H11NO4 MW 221.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11NO4/c1-2-3-8-6-10-11(16-5-4-15-10)7-9(8)12(13)14/h2,6-7H,1,3-5H2
InChIKey
VLILERXSVVSKCW-UHFFFAOYSA-N
Synonyms

6nitro7(prop2en1yl)23dihydro14benzodioxine
6nitro7prop2enyl23dihydro14benzodioxine
C=CCC1=CC2=C(C=C1(N+)(=O)(O))OCCO2
C=CCc1cc2OCCOc2cc1(N+)(=O)(O)
InChI=1SC11H11NO4c123861011(16541510)79(8)12(13)14h267H135H2
MFCD24850208
ZINC000095482057
ZINC95482057

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Available files

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