Basic information
- CAS
63040-64-2- Standard SMILES
CN(C)c1ccc(N=Nc2cccc3cnccc23)cc1- InChIKey
RWZUPXHMZXBKQY-UHFFFAOYSA-N- Molecular formula
- C17H16N4
- Average molar mass
- 276.34 g/mol
- Monoisotopic mass
- 276.13749653
Names & identifiers
- Preferred name
- 5-((p-(Dimethylamino)phenyl)azo)isoquinoline
- IUPAC
- 4-(isoquinolin-5-yldiazenyl)-N,N-dimethylaniline
- English name
- 5-[(p-Dimethylaminophenyl)azo]isoquinoline
- Molecular formula
- C17H16N4
- Molecular weight
- 276.34
Names & synonyms
63040-64-2N,N-Dimethyl-4-(5'-isoquinolinylazo)aniline5-((p-(Dimethylamino)phenyl)azo)isoquinolineISOQUINOLINE, 5-((p-(DIMETHYLAMINO)PHENYL)AZO)-DTXSID201040271Benzenamine, 4-[2-(5-isoquinolinyl)diazenyl]-N,N-dimethyl-5-[(p-Dimethylaminophenyl)azo]isoquinoline
Database identifiers
- CAS
63040-64-2- PubChem CID
- 44353
- DTXSID
DTXSID201040271- Nikkaji
- J68.843F
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 40.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 347
Physicochemical properties
- Boiling point
- 409.24 °C · 409.24°C (rough estimate)
- Density
- 1.1539 · 1.1539 (rough estimate)
- refractive index
- 1.6 · 1.6000 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…