Basic information
- CAS
105467-74-1- Standard SMILES
O=c1c2c(ccc3ccccc32)[nH]c2ccc3ccccc3c12- InChIKey
OITULNAOGROFKX-UHFFFAOYSA-N- Molecular formula
- C21H13NO
- Average molar mass
- 295.3 g/mol
- Monoisotopic mass
- 295.09971404
Names & identifiers
- Preferred name
- Dibenz(a,j)acridin-14(7H)-one
- IUPAC
- 13-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaen-2-one
Names & synonyms
105467-74-1Dibenz(a,j)acridin-14(7H)-oneDTXSID80147144RefChem:336976DTXCID9069635dibenzo[a,j]acridin-14(7H)-one13-Azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaen-2-one
Database identifiers
- CAS
105467-74-1- PubChem CID
- 149690
- DTXSID
DTXSID80147144- Nikkaji
- J3.614.159J
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 434
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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