Vitas-M small molecule compound

5-methoxy-8-nitro-2,3-dihydro-1,4-benzodioxine

Catalog ID
STL325669
SMILES COc1ccc(c2c1OCCO2)[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 C9H9NO5 MW 211.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9NO5/c1-13-7-3-2-6(10(11)12)8-9(7)15-5-4-14-8/h2-3H,4-5H2,1H3
InChIKey
RRCXRLKYMHDLAB-UHFFFAOYSA-N
Synonyms
60458-85-7
5methoxy8nitro23dihydro14benzodioxine
5methoxy8nitro23dihydrobenzo(b)(14)dioxine
60458857
COC1=C2C(=C(C=C1)(N+)(=O)(O))OCCO2
COc1ccc(c2c1OCCO2)(N+)(=O)(O)
InChI=1SC9H9NO5c1137326(10(11)12)89(7)1554148h23H45H21H3
MFCD01116995
ZINC000004837042
ZINC04837042
ZINC4837042

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Available files

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