Basic information
- Standard SMILES
CC(=O)OC(C)C(=O)C1=C(Cl)CCC1- InChIKey
HIPKGLOZRKJXOL-UHFFFAOYSA-N- Molecular formula
- C10H13ClO3
- Average molar mass
- 216.66 g/mol
Names & identifiers
- Preferred name
- 1-(2-Chlorocyclopent-1-enyl)-1-oxopropan-2-yl acetate
- IUPAC
- [1-(2-chlorocyclopenten-1-yl)-1-oxopropan-2-yl] acetate
Names & synonyms
SCHEMBL13857984HIPKGLOZRKJXOL-UHFFFAOYSA-N1-(2-chlorocyclopent-1-enyl)-1-oxopropan-2-yl acetate
Database identifiers
- PubChem CID
- 71014130
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 294
Related reactions
3 records
Compound notes
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