Basic information
- CAS
6364-39-2- Standard SMILES
Cc1cc(N=Nc2cccc3ccccc23)c(N)cc1N- InChIKey
ISAXZYNEXMETQQ-UHFFFAOYSA-N- Molecular formula
- C17H16N4
- Average molar mass
- 276.34 g/mol
- Monoisotopic mass
- 276.13749653
Names & identifiers
- Preferred name
- 4-Methyl-6-(2-(1-naphthalenyl)diazenyl)-1,3-benzenediamine
- IUPAC
- 4-methyl-6-(naphthalen-1-yldiazenyl)benzene-1,3-diamine
- English name
- 4-methyl-6-(naphthylazo)benzene-1,3-diamine
- Molecular formula
- C17H16N4
- Molecular weight
- 276.34
Names & synonyms
6364-39-24-Methyl-6-(2-(1-naphthalenyl)diazenyl)-1,3-benzenediamine4-Methyl-6-[2-(1-naphthalenyl)diazenyl]-1,3-benzenediamineRefChem:2943964-Methyl-6-(naphthylazo)benzene-1,3-diamine4-methyl-6-(naphthalen-1-yldiazenyl)benzene-1,3-diamineEINECS 228-856-21,3-Benzenediamine, 4-methyl-6-(1-naphthalenylazo)-SCHEMBL28555440DTXSID50863768ISAXZYNEXMETQQ-UHFFFAOYSA-NNS00043382
Show more names
C.I.11330Solvent Brown 2C.I.Solvent Brown 2C.I.Solvent Brown 2:C.I.113304-methyl-6-[1]naphthylazo-m-phenylenediamine4-Methyl-6-[(naphthalen-1-yl)azo]-1,3-benzenediamine1,3-Benzenediamine, 4-methyl-6-[2-(1-naphthalenyl)diazenyl]-
4-Methyl-6-[(naphthalen-1-yl)diazenyl]benzene-1,3-diamine
Database identifiers
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 76.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- Boiling point
- 535.8 · 535.8±50.0 °C(Predicted)
- Density
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- pka
- 2.82 · 2.82±0.13(Predicted)
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: 1,3-Benzenediamine, 4-methyl-6-(1-naphthalenylazo)-
Chemistry & industry
Preparation methods
PreparationNaphthalen-1-amine diazotization, and 4-Methylbenzene-1,3-diamine coupling.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…