Vitas-M small molecule compound
2,1,3-benzoxadiazole-5,6-dicarbonitrile 1-oxide
Catalog ID
STK689095
SMILES N#Cc1cc2c(cc1C#N)no[n+]2[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 C8H2N4O2 MW 186.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H2N4O2/c9-3-5-1-7-8(2-6(5)4-10)12(13)14-11-7/h1-2HInChIKey
QLWBVUQXDHPWMI-UHFFFAOYSA-NSynonyms
1HYDROXYBENZO(C)125OXADIAZOLE56DICARBONITRILE
213benzoxadiazole56dicarbonitrile1oxide
3OXIDO213BENZOXADIAZOL3IUM56DICARBONITRILE
C1=C(C(=CC2=(N+)(ON=C21)(O))C#N)C#N
InChI=1SC8H2N4O2c935178(26(5)410)12(13)14117h12H
MFCD07800368
N#Cc1cc2c(cc1C#N)no(n+)2(O)
ZINC000004786619
ZINC04786619
ZINC4786619
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