Basic information
- CAS
24313-89-1- Standard SMILES
COc1cc(N=[N+]([O-])c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC- InChIKey
ACXGKPMWHRADKL-UHFFFAOYSA-N- Molecular formula
- C18H22N2O7
- Average molar mass
- 378.4 g/mol
- Monoisotopic mass
- 378.14270105
Names & identifiers
- Preferred name
- Oxido-(3,4,5-trimethoxyphenyl)-(3,4,5-trimethoxyphenyl)iminoazanium
- IUPAC
- oxido-(3,4,5-trimethoxyphenyl)-(3,4,5-trimethoxyphenyl)iminoazanium
- English name
- 3,3',4,4',5,5'-Hexamethoxyazoxybenzene
- Molecular formula
- C18H22N2O7
- Molecular weight
- 378.38
Names & synonyms
3,3',4,4',5,5'-HexamethoxyazoxybenzeneAzoxybenzene, 3,3',4,4',5,5'-hexamethoxy- (8CI)
Database identifiers
- CAS
24313-89-1- PubChem CID
- 597682
- DTXSID
DTXSID801270149- Nikkaji
- J146.261J
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 451
Physicochemical properties
- Boiling point
- 534.7 · 534.7±60.0 °C(Predicted)
- Density
- 1.21 · 1.21±0.1 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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