Basic information
- CAS
218-19-9- Standard SMILES
c1ccc2c(c1)ccc1c2ccc2cccnc21- InChIKey
OZIRORHUKSXTLG-UHFFFAOYSA-N- Molecular formula
- C17H11N
- Average molar mass
- 229.27 g/mol
- Monoisotopic mass
- 229.08914936
Names & identifiers
- Preferred name
- 4-Azachrysene
- IUPAC
- naphtho[1,2-h]quinoline
Names & synonyms
4-Azachrysenenaphtho[1,2-h]quinolineNAPHTHO(1,2-h)QUINOLINE218-19-9CCRIS 1606NaphthochinolinBRN 0154997SCHEMBL686683SCHEMBL30317540DTXSID80176212
Database identifiers
- CAS
218-19-9- PubChem CID
- 9174
- DTXSID
DTXSID80176212- Nikkaji
- J1.879.643K
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 300
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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