Vitas-M small molecule compound

1,3-dinitrodibenzo[b,f]oxepine

Catalog ID
STK760096
SMILES [O-][N+](=O)c1cc(cc2c1C=Cc1c(O2)cccc1)[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 C14H8N2O5 MW 284.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H8N2O5/c17-15(18)10-7-12(16(19)20)11-6-5-9-3-1-2-4-13(9)21-14(11)8-10/h1-8H
InChIKey
NOHKLRGEWUCJIL-UHFFFAOYSA-N
Synonyms
96955-62-3
(O)(N+)(=O)c1cc(cc2c1C=Cc1c(O2)cccc1)(N+)(=O)(O)
13DINITRODIBENZO(BF)OXEPIN
13dinitrodibenzo(bf)oxepine
24DINITROBENZO(B)(1)BENZOXEPINE
96955623
C1=CC=C2C(=C1)C=CC3=C(C=C(C=C3O2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC14H8N2O5c1715(18)10712(16(19)20)11659312413(9)2114(11)810h18H
MFCD01571842
ZINC000002025085
ZINC02025085
ZINC2025085

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Available files

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