Basic information
- CAS
5714-12-5- Standard SMILES
[O-][n+]1onc2c1ccc1no[n+]([O-])c12- InChIKey
FEIJYIVWKGWTHQ-UHFFFAOYSA-N- Molecular formula
- C6H2N4O4
- Average molar mass
- 194.1 g/mol
- Monoisotopic mass
- 194.00760456
Overview
structure
Names & identifiers
- Preferred name
- Furoxanobenzofuroxan
- IUPAC
- 3,8-dioxido-[1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole-3,8-diium
- English name
- benzo(1,2-c:3,4-c')bis(1,2,5)oxadiazole-1,6-dioxide
- Molecular formula
- C6H2N4O4
- Molecular weight
- 194.1
Names & synonyms
Furoxanobenzofuroxan5714-12-5NSC-228139R9H8L243TCBenzo(1,2-c:3,4-c')bis(1,2,5)oxadiazole, 3,8-dioxideRefChem:1418473,8-dioxido-[1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole-3,8-diiumNSC228139DS-012158Benzo[1,4-c']bis[1,2,5]oxadiazole, 1,6-dioxideBenzo[1,4-c']bis[1,2,5]oxadiazole, 3,8-dioxidephenethyl 4-(2-chlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Show more names
benzo(1,2-c:3,4-c')bis(1,2,5)oxadiazole-1,6-dioxide
Database identifiers
- CAS
5714-12-5- PubChem CID
- 313608
- DTXSID
DTXSID90972601- UNII
- R9H8L243TC
- Nikkaji
- J342.195C
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 242
Physicochemical properties
- FDA UNII
- 9 H8L243TC · R9H8L243TC
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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