Vitas-M small molecule compound
1,3-dinitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Catalog ID
STK762776
SMILES O=C1Nc2ccccc2Oc2c1c(cc(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 C13H7N3O6 MW 301.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7N3O6/c17-13-12-9(16(20)21)5-7(15(18)19)6-11(12)22-10-4-2-1-3-8(10)14-13/h1-6H,(H,14,17)InChIKey
KLNXLERKYIWYAC-UHFFFAOYSA-NSynonyms
309735-46-413DINITRO10HDIBENZO(BF)14OXAZEPIN11ONE
13dinitrodibenzo(bf)(14)oxazepin11(10H)one
13DINITRODIBENZO(BF)(14)OXAZEPINE11(10H)ONE
309735464
79DINITRO5HBENZO(B)(14)BENZOXAZEPIN6ONE
C1=CC=C2C(=C1)NC(=O)C3=C(C=C(C=C3O2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H7N3O6c1713129(16(20)21)57(15(18)19)611(12)221042138(10)1413h16H(H1417)
MFCD02110520
O=C1Nc2ccccc2Oc2c1c(cc(c2)(N+)(=O)(O))(N+)(=O)(O)
ZINC000002025124
ZINC02025124
ZINC2025124
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