Basic information
- CAS
7267-90-5- Standard SMILES
O=c1c2ccccc2c2cc3ccc4cccc5ccc(c12)c3c45- InChIKey
CIXQFTJGIONQCO-UHFFFAOYSA-N- Molecular formula
- C23H12O
- Average molar mass
- 304.3 g/mol
- Monoisotopic mass
- 304.088815
Names & identifiers
- Preferred name
- 11H-Indeno(2,1-a)pyren-11-one
- IUPAC
- hexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15(23),16,18,20-undecaen-3-one
Names & synonyms
11H-INDENO(2,1-A)PYREN-11-ONE7267-90-5DTXSID4022298111H-indeno[2,1-a]pyren-11-oneRefChem:236315DTXCID70145472indeno[2,1-a]pyren-11-one
Database identifiers
- CAS
7267-90-5- PubChem CID
- 23692
- DTXSID
DTXSID40222981- Nikkaji
- J1.556.063K
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 538
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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