2,2'-Pyrene-1,8-diyldioxirane
Basic information
- CAS
86470-95-3- Standard SMILES
c1cc2ccc3ccc(C4CO4)c4ccc(c1C1CO1)c2c34- InChIKey
BCLNPCPPEJWCER-UHFFFAOYSA-N- Molecular formula
- C20H14O2
- Average molar mass
- 286.3 g/mol
- Monoisotopic mass
- 286.09937969
Names & identifiers
- Preferred name
- 2,2'-Pyrene-1,8-diyldioxirane
- IUPAC
- 2-[8-(oxiran-2-yl)pyren-1-yl]oxirane
Names & synonyms
86470-95-32,2'-pyrene-1,8-diyldioxirane2-(8-(Oxiran-2-yl)pyren-1-yloxiraneDTXSID5010068482,2'-(Pyrene-1,8-diyl)bis(oxirane)
Database identifiers
- CAS
86470-95-3- PubChem CID
- 186344
- DTXSID
DTXSID501006848
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 25.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 421
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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