Basic information
- CAS
2944-27-6- Standard SMILES
O=C1c2cccc(Nc3ccccc3)c2C(=O)c2cccc(Nc3ccccc3)c21- InChIKey
VMDUEJVMKSOQEZ-UHFFFAOYSA-N- Molecular formula
- C26H18N2O2
- Average molar mass
- 390.4 g/mol
- Monoisotopic mass
- 390.13682782
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1,5-bis(phenylamino)-
- IUPAC
- 1,5-dianilinoanthracene-9,10-dione
- English name
- 1,5-Bis(phenylamino)-9,10-anthracenedione
- Molecular formula
- C26H18N2O2
- Molecular weight
- 390.43
Names & synonyms
1,5-Dianilinoanthraquinone2944-27-69,10-Anthracenedione, 1,5-bis(phenylamino)-DTXSID3062732RefChem:548574DTXCID00379941,5-bis(phenylamino)anthracene-9,10-dione1,5-dianilinoanthracene-9,10-dione1,5-Bis(phenylamino)-9,10-anthracenedioneSCHEMBL2612577VMDUEJVMKSOQEZ-UHFFFAOYSA-NAKOS000668672
Show more names
N,N'-diphenyl-1 ,5-diaminoanthraquinone
Database identifiers
- CAS
2944-27-6- PubChem CID
- 76266
- DTXSID
DTXSID3062732- Nikkaji
- J421.645H
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 569
Physicochemical properties
- Melting point
- 254 · 254.0-254.4 °C
- Boiling point
- 610.3 · 610.3±55.0 °C(Predicted)
- Density
- 1.341 · 1.341±0.06 g/cm3(Predicted)
- pka
- -2.22 · -2.22±0.20(Predicted)
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1,5-bis(phenylamino)- (2944-27-6)
- 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.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,10-Anthracenedione, 1,5-bis(phenylamino)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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