2-Anthracenecarbonitrile, 1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-
Basic information
- CAS
32571-82-7- Standard SMILES
N#Cc1cc(Nc2ccccc2)c2c(c1N)C(=O)c1ccccc1C2=O- InChIKey
FJMZFDACASWQCW-UHFFFAOYSA-N- Molecular formula
- C21H13N3O2
- Average molar mass
- 339.3 g/mol
- Monoisotopic mass
- 339.10077667
Names & identifiers
- Preferred name
- 2-Anthracenecarbonitrile, 1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-
- IUPAC
- 1-amino-4-anilino-9,10-dioxoanthracene-2-carbonitrile
- English name
- 1-amino-4-anilino-9,10-dihydro-9,10-dioxoanthracene-2-carbonitrile
- Molecular formula
- C21H13N3O2
- Molecular weight
- 339.34682
Names & synonyms
32571-82-7EINECS 251-102-92-Anthracenecarbonitrile, 1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-DTXSID90676972-Anthracenecarbonitrile,1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-RefChem:465245DTXCID10385331-Amino-4-anilino-9,10-dihydro-9,10-dioxoanthracene-2-carbonitrileSCHEMBL3134141FJMZFDACASWQCW-UHFFFAOYSA-N1-Amino-4-anilino-9,10-dioxo-9,10-dihydroanthracene-2-carbonitrileNS00029298
Show more names
1-Amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-2-anthracenecarbonitrile
InChI=1/C21H13N3O2/c22-11-12-10-16(24-13-6-2-1-3-7-13)17-18(19(12)23)21(26)15-9-5-4-8-14(15)20(17)25/h1-10,24H,23H
Database identifiers
- CAS
32571-82-7- PubChem CID
- 122902
- DTXSID
DTXSID9067697- EC Number
- 251-102-9
- Nikkaji
- J319.399C
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 618
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-Anthracenecarbonitrile, 1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)- (32571-82-7)
- 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-Anthracenecarbonitrile, 1-amino-9,10-dihydro-9,10-dioxo-4-(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 Information2-Anthracenecarbonitrile, 1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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