9,10-Anthracenedione, 1-(cyclohexylamino)-
Basic information
- CAS
1096-48-6- Standard SMILES
O=C1c2ccccc2C(=O)c2c(NC3CCCCC3)cccc21- InChIKey
BWQIGAJDKXZJTG-UHFFFAOYSA-N- Molecular formula
- C20H19NO2
- Average molar mass
- 305.4 g/mol
- Monoisotopic mass
- 305.14157885
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1-(cyclohexylamino)-
- IUPAC
- 1-(cyclohexylamino)anthracene-9,10-dione
- English name
- 1-(cyclohexylaminoanthraquinone)
- Molecular formula
- C20H19NO2
- Molecular weight
- 305.37
Names & synonyms
1-(cyclohexylamino)anthracene-9,10-dione1096-48-671832-19-49,10-Anthracenedione, 1-(cyclohexylamino)-1-(Cyclohexylaminoanthraquinone)1-Cyclohexanaminoanthracene-9,10-dioneEINECS 214-143-3DTXSID2061484RefChem:548628C.I. Solvent Red 168DTXCID8033140DTXSID801059927
Show more names
1-(cyclohexylamino)-10-anthracenedione10-Anthracenedione, 1-(cyclohexylamino)-9
214-143-3615-553-9Solvent Red 1681-cyclohexylaminoanthraquinone9,10-Anthracenedione,1-(cyclohexylamino)-1-Cyclohexylamino-anthrachinonabcol red 168CBMicro_016349
Database identifiers
- CAS
1096-48-6、71832-19-4- PubChem CID
- 70669
- DTXSID
DTXSID2061484- EC Number
- 214-143-3、615-553-9
- Nikkaji
- J52.239B
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 468
Physicochemical properties
- Melting point
- 145 · 145-146 °C
- Boiling point
- 526.1 · 526.1±39.0 °C(Predicted)
- Density
- 1.266 · 1.266±0.06 g/cm3(Predicted)
- pka
- 2.88 · 2.88±0.20(Predicted)
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1-(cyclohexylamino)- (1096-48-6)
- 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.
GHS classification
GHS Classification
Not Classified
Not Classified
Hazard information
Regulatory InformationChemical: 9,10-Anthracenedione, 1-(cyclohexylamino)-
Hazard Classes and Categories
Not Classified
Not Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,10-Anthracenedione, 1-(cyclohexylamino)-: ACTIVE
Related reactions
3 records
Compound notes
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