Basic information
- CAS
21810-19-5- Standard SMILES
N=C(c1ccccc1)c1ccc2c(c1N)C(=O)c1ccccc1C2=O- InChIKey
YZVXUKFBBWNKDG-UHFFFAOYSA-N- Molecular formula
- C21H14N2O2
- Average molar mass
- 326.3 g/mol
- Monoisotopic mass
- 326.10552769
Names & identifiers
- Preferred name
- 1-Amino-2-((phenylimino)methyl)anthraquinone
- IUPAC
- 1-amino-2-(benzenecarboximidoyl)anthracene-9,10-dione
Names & synonyms
1-Amino-2-((phenylimino)methyl)anthraquinone1-AMINO-2-[(PHENYLIMINO)METHYL]ANTHRAQUINONEEINECS 244-586-8DTXSID509444201-Amino-2-[imino(phenyl)methyl]anthracene-9,10-dione
Database identifiers
- CAS
21810-19-5- PubChem CID
- 89063
- DTXSID
DTXSID50944420
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 566
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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