3-(Dodec-1-EN-1-YL)furan-2,5-dione
Basic information
- CAS
59426-47-0- Standard SMILES
CCCCCCCCCCC=CC1=CC(=O)OC1=O- InChIKey
VVJWDPAFRDCADU-UHFFFAOYSA-N- Molecular formula
- C16H24O3
- Average molar mass
- 264.36 g/mol
- Monoisotopic mass
- 264.17254462
Names & identifiers
- Preferred name
- 3-(Dodec-1-EN-1-YL)furan-2,5-dione
- IUPAC
- 3-dodec-1-enylfuran-2,5-dione
Names & synonyms
59426-47-03-(DODEC-1-EN-1-YL)FURAN-2,5-DIONESCHEMBL6405455DTXSID70787154
Database identifiers
- CAS
59426-47-0- PubChem CID
- 71363639
- DTXSID
DTXSID70787154
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…