4-Methylidene-4,6-dihydrobenzo[pqr]tetraphen-6-ido
Basic information
- CAS
123358-44-1- Standard SMILES
[CH2-]c1cc2cc3ccccc3c3ccc4cccc1c4c23- InChIKey
KGZYIUVIFUOELZ-UHFFFAOYSA-N- Molecular formula
- C21H13-
- Average molar mass
- 265.3 g/mol
- Monoisotopic mass
- 265.10172542
Names & identifiers
- Preferred name
- 4-Methylidene-4,6-dihydrobenzo[pqr]tetraphen-6-ido
- IUPAC
- 4-methanidylbenzo[a]pyrene
Names & synonyms
4-Methylidene-4,6-dihydrobenzo[pqr]tetraphen-6-idoDTXSID409244784-Methylidene-4,6-dihydrobenzo[pqr]tetraphen-6-ide
Database identifiers
- CAS
123358-44-1- PubChem CID
- 180189
- DTXSID
DTXSID40924478
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- -1
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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