Basic information
- Standard SMILES
CC(=O)OC1C=CC(OC2CCCCO2)C1- InChIKey
CMRVFMLNWHLDBN-UHFFFAOYSA-N- Molecular formula
- C12H18O4
- Average molar mass
- 226.27 g/mol
- Monoisotopic mass
- 226.12050905
Names & identifiers
- Preferred name
- [4-(Oxan-2-yloxy)cyclopent-2-en-1-yl] acetate
- IUPAC
- [4-(oxan-2-yloxy)cyclopent-2-en-1-yl] acetate
Names & synonyms
SCHEMBL11549069
Database identifiers
- PubChem CID
- 13623282
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 274
Related reactions
1 records
Compound notes
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