Basic information
- CAS
73116-44-6- Standard SMILES
CCOC(=O)CCCCCCCCCc1ccc2ccc3cccc4ccc1c2c34- InChIKey
NQHKHIRRAANLSX-UHFFFAOYSA-N- Molecular formula
- C28H32O2
- Average molar mass
- 400.6 g/mol
- Monoisotopic mass
- 400.24023026
Names & identifiers
- Preferred name
- Ethyl 10-(pyren-1-YL)decanoate
- IUPAC
- ethyl 10-pyren-1-yldecanoate
Names & synonyms
73116-44-6ETHYL 10-(PYREN-1-YL)DECANOATESCHEMBL9883405DTXSID10823146
Database identifiers
- CAS
73116-44-6- PubChem CID
- 71402151
- DTXSID
DTXSID10823146
Properties
Computed structural properties
- XLogP
- 9.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 529
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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