Basic information
- CAS
120362-67-6- Standard SMILES
CC(=O)c1cccc2c1-c1ccc3ccc4cccc5cc-2c1c3c45- InChIKey
QSQXFGYKWUAYNQ-UHFFFAOYSA-N- Molecular formula
- C24H14O
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 318.10446507
Names & identifiers
- Preferred name
- Ethanone, 1-indeno(1,2,3-cd)pyren-12-yl-
- IUPAC
- 1-(6-hexacyclo[16.3.1.02,7.08,21.011,20.014,19]docosa-1(22),2(7),3,5,8(21),9,11(20),12,14(19),15,17-undecaenyl)ethanone
Names & synonyms
Ethanone, 1-indeno(1,2,3-cd)pyren-12-yl-120362-67-61-Indeno(1,2,3-cd)pyren-12-ylethanoneDTXSID501528211-(Indeno[1,2,3-cd]pyren-10-yl)ethan-1-one
Database identifiers
- CAS
120362-67-6- PubChem CID
- 147482
- DTXSID
DTXSID50152821
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 566
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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