4-Hydroxydibenz(a,j)acridine
Basic information
- CAS
105467-67-2- Standard SMILES
O=c1cccc2c1ccc1[nH]c3ccc4ccccc4c3cc12- InChIKey
KLTMVHPZQSTVBB-UHFFFAOYSA-N- Molecular formula
- C21H13NO
- Average molar mass
- 295.3 g/mol
- Monoisotopic mass
- 295.09971404
Names & identifiers
- Preferred name
- 4-Hydroxydibenz(a,j)acridine
- IUPAC
- 13-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),2,4,6,9,11,15,17,19,21-decaen-8-one
- English name
- 4-Hydroxydibenz(a,j)acridine
- Molecular formula
- C21H13NO
- Molecular weight
- 295.33
Names & synonyms
4-Hydroxydibenz(a,j)acridine105467-67-2Dibenzo[a,j]acridin-4-ol4-Hydroxydibenz[a,j]acridineCCRIS 3313Dibenz(a,j)acridin-4-olDibenzo[a,j]acridin-4(7H)-oneDTXSID7090955113-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),2,4,6,9,11,15,17,19,21-decaen-8-oneDibenz[a,j]acridin-4-ol
Database identifiers
- CAS
105467-67-2- PubChem CID
- 149689
- DTXSID
DTXSID70909551- Nikkaji
- J348.013E
Properties
Computed structural properties
- XLogP
- 4.2
- 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
- 718
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Compound notes
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