5,5'-(Pentane-1,5-diyl)bis(3-methylideneoxolan-2-one)
Basic information
- CAS
57899-40-8- Standard SMILES
C=C1CC(CCCCCC2CC(=C)C(=O)O2)OC1=O- InChIKey
DZTXELBOZZHUEL-UHFFFAOYSA-N- Molecular formula
- C15H20O4
- Average molar mass
- 264.32 g/mol
- Monoisotopic mass
- 264.13615911
Names & identifiers
- Preferred name
- 5,5'-(Pentane-1,5-diyl)bis(3-methylideneoxolan-2-one)
- IUPAC
- 3-methylidene-5-[5-(4-methylidene-5-oxooxolan-2-yl)pentyl]oxolan-2-one
Names & synonyms
57899-40-8NSC205372CHEMBL32748815,5'-(Pentane-1,5-diyl)bis(3-methylideneoxolan-2-one)DTXSID70308601NSC-205372
Database identifiers
- CAS
57899-40-8- PubChem CID
- 307268
- DTXSID
DTXSID70308601- ChEMBL
CHEMBL3274881
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…