Basic information
- CAS
72927-71-0- Standard SMILES
CCOc1cc(C(c2ccccc2)c2ccc(N=Nc3c(O)ccc4ccccc34)c(OCC)c2)ccc1N=Nc1c(O)ccc2ccccc12- InChIKey
UREMJLRMOYIAQO-UHFFFAOYSA-N- Molecular formula
- C43H36N4O4
- Average molar mass
- 672.8 g/mol
- Monoisotopic mass
- 672.27365564
Names & identifiers
- Preferred name
- 2-Naphthalenol, 1,1'-((phenylmethylene)bis((2-ethoxy-4,1-phenylene)-2,1-diazenediyl))bis-
- IUPAC
- 1-[[2-ethoxy-4-[[3-ethoxy-4-[(2-hydroxynaphthalen-1-yl)diazenyl]phenyl]-phenylmethyl]phenyl]diazenyl]naphthalen-2-ol
- English name
- 1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)azo]]bis(2-naphthol)
- Molecular formula
- C43H36N4O4
- Molecular weight
- 672.77
Names & synonyms
EINECS 277-019-82-Naphthalenol, 1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)azo]]bis-DTXSID00726491,1'-((Phenylmethylene)bis((2-ethoxy-4,1-phenylene)azo))bis(2-naphthalenol)2-Naphthalenol, 1,1'-((phenylmethylene)bis((2-ethoxy-4,1-phenylene)azo))bis-2-Naphthalenol, 1,1'-((phenylmethylene)bis((2-ethoxy-4,1-phenylene)-2,1-diazenediyl))bis-2-Naphthalenol, 1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)-2,1-diazenediyl]]bis-RefChem:477061DTXCID004740272927-71-0UREMJLRMOYIAQO-UHFFFAOYSA-NNS00061798
Show more names
1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)azo]]bis(2-naphthol)1,1'-[(Phenylmethylene)bis[(2-ethoxy-4,1-phenylene)azo]]bis(2-naphthalenol)2-Naphthalenol, 1,1'-[(phenylmethylene)bis[ (2-ethoxy-4,1-phenylene)azo]]bis-2-Naphthalenol,1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)-2,1-diazenediyl]]bis-
1,1'-((Phenylmethylene)bis((2-ethoxy-4,1-phenylene)azo))bis(2-naphthol)1,1'-{(Phenylmethylene)bis[(2-ethoxy-4,1-phenylene)diazene-2,1-diyl]}di(naphthalen-2-ol)
Properties
Computed structural properties
- XLogP
- 11.3
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 51
- Formal charge
- 0
- Complexity
- 1,040
Physicochemical properties
- Boiling point
- 884.022 · 884.022±65.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.227 · 1.227±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 13.311 · 13.311±0.50(predicted)
- EPA Substance Registry System
- 2 · 2-Naphthalenol, 1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)azo]]bis- (72927-71-0)
- 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: 2-Naphthalenol, 1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)azo]]bis-
Other Safety InformationIMAP assessments - 2-Naphthalenol, 1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)azo]]bis-: Human health tier I assessment
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Naphthalenol, 1,1'-[(phenylmethylene)bis[(2-ethoxy-4,1-phenylene)-2,1-diazenediyl]]bis-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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