Vitas-M small molecule compound

6-ethoxy-1,3-dinitrodibenzo[b,f]oxepine

Catalog ID
STK761203
SMILES CCOc1cccc2c1Oc1cc(cc(c1C=C2)[N+](=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 C16H12N2O6 MW 328.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O6/c1-2-23-14-5-3-4-10-6-7-12-13(18(21)22)8-11(17(19)20)9-15(12)24-16(10)14/h3-9H,2H2,1H3
InChIKey
JQDGZGVLPUPGEK-UHFFFAOYSA-N
Synonyms

10ETHOXY24DINITROBENZO(B)(1)BENZOXEPINE
6ETHOXY13DINITRODIBENZO(BF)OXEPIN
6ethoxy13dinitrodibenzo(bf)oxepine
CCOC1=CC=CC2=C1OC3=CC(=CC(=C3C=C2)(N+)(=O)(O))(N+)(=O)(O)
CCOc1cccc2c1Oc1cc(cc(c1C=C2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H12N2O6c12231453410671213(18(21)22)811(17(19)20)915(12)2416(10)14h39H2H21H3
MFCD01820789
ZINC000003669830
ZINC03669830
ZINC3669830

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Available files

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