Vitas-M small molecule compound
1-(7-methoxy-1,3-benzodioxol-5-yl)-2-nitroethanone
Catalog ID
STL434065
SMILES COc1cc(cc2c1OCO2)C(=O)C[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 C10H9NO6 MW 239.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9NO6/c1-15-8-2-6(7(12)4-11(13)14)3-9-10(8)17-5-16-9/h2-3H,4-5H2,1H3InChIKey
IKAQXPVNXGFJOG-UHFFFAOYSA-NSynonyms
1(7methoxy13benzodioxol5yl)2nitroethanone
COC1=CC(=CC2=C1OCO2)C(=O)C(N+)(=O)(O)
COc1cc(cc2c1OCO2)C(=O)C(N+)(=O)(O)
InChI=1SC10H9NO6c115826(7(12)411(13)14)3910(8)175169h23H45H21H3
MFCD24540271
ZINC000100023602
ZINC100023602
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