Basic information
- CAS
19471-27-3- Standard SMILES
Cc1c[n+]([O-])c(C)cc1N=Nc1ccc(N(C)C)cc1- InChIKey
DARHBAXRKHMSAX-UHFFFAOYSA-N- Molecular formula
- C15H18N4O
- Average molar mass
- 270.33 g/mol
- Monoisotopic mass
- 270.14806121
Names & identifiers
- Preferred name
- 2,5-LUTIDINE, 4-((p-(DIMETHYLAMINO)PHENYL)AZO)-, 1-OXIDE
- IUPAC
- 4-[(2,5-dimethyl-1-oxidopyridin-1-ium-4-yl)diazenyl]-N,N-dimethylaniline
- English name
- 4-[[p-(Dimethylamino)phenyl]azo]-2,5-dimethylpyridine 1-oxide
- Molecular formula
- C15H18N4O
- Molecular weight
- 270.33
Names & synonyms
19471-27-3NSC 1706752,5-LUTIDINE, 4-((p-(DIMETHYLAMINO)PHENYL)AZO)-, 1-OXIDE4-((p-(Dimethylamino)phenyl)azo)-2,5-lutidine 1-oxide4-[[p-(Dimethylamino)phenyl]azo]-2,5-dimethylpyridine 1-oxideN,N-Dimethyl-4-(4'-(2',5'-dimethylpyridyl-1'-oxide)azo)aniline4-[(2,5-dimethyl-1-oxidopyridin-1-ium-4-yl)diazenyl]-N,N-dimethylanilineNSC170675Benzenamine, 4-((2,5-dimethyl-4-pyridinyl)azo)-N,N-dimethyl-, N-oxideNSC-170675
Database identifiers
- CAS
19471-27-3- PubChem CID
- 29623
- Nikkaji
- J36.803B
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Boiling point
- 413.44 °C · 413.44°C (rough estimate)
- Density
- 1.0841 · 1.0841 (rough estimate)
- refractive index
- 1.65 · 1.6500 (estimate)
- pka
- 3.274 · 3.274±0.10(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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