3-Pyridinecarbonitrile, 5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-
Basic information
- CAS
68214-64-2- Standard SMILES
Cc1c(C#N)c(O)n(Nc2ccccc2)c(=O)c1N=Nc1cccc(Cl)c1- InChIKey
VUUPJZOMEVYEJV-UHFFFAOYSA-N- Molecular formula
- C19H14ClN5O2
- Average molar mass
- 379.8 g/mol
- Monoisotopic mass
- 379.0836024
Names & identifiers
- Preferred name
- 3-Pyridinecarbonitrile, 5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-
- IUPAC
- 1-anilino-5-[(3-chlorophenyl)diazenyl]-2-hydroxy-4-methyl-6-oxopyridine-3-carbonitrile
- English name
- 5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile
- Molecular formula
- C19H14ClN5O2
- Molecular weight
- 379.8
Names & synonyms
3-Pyridinecarbonitrile, 5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-DTXSID00712593-Pyridinecarbonitrile, 5-((3-chlorophenyl)azo)-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-RefChem:505154DTXCID004570968214-64-2EINECS 269-306-13-Pyridinecarbonitrile, 5-(2-(3-chlorophenyl)diazenyl)-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-3-Pyridinecarbonitrile, 5-[2-(3-chlorophenyl)diazenyl]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-L8J2XVY8EQKNNJXWRYZLKLGT-UHFFFAOYSA-NVUUPJZOMEVYEJV-UHFFFAOYSA-N
Show more names
1-Anilino-3-cyano-5-(3-chlorophenylazo)-6-hydroxy-4-methyl-2(1H)-pyridone5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-3-pyridinecarbonitrile5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-3-Pyridinecarbonitrile2-oxo-1-(phenylamino)-5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-3-pyridinecarbonitrile
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 730
Physicochemical properties
- Boiling point
- 441.1 · 441.1±55.0 °C(Predicted)
- Density
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- pka
- -0.28 · -0.28±0.58(Predicted)
- EPA Substance Registry System
- 3 · 3-Pyridinecarbonitrile, 5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)- (68214-64-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 3-Pyridinecarbonitrile, 5-[(3-chlorophenyl)azo]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3-Pyridinecarbonitrile, 5-[2-(3-chlorophenyl)diazenyl]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…