Basic information
- Standard SMILES
CC1(C)C(C=CC(=O)OCC2CC2)C1C(=O)[O-]- InChIKey
IGUWGEBAHCMQSS-UHFFFAOYSA-M- Molecular formula
- C13H17O4-
- Average molar mass
- 237.27 g/mol
Names & identifiers
- Preferred name
- 2,2-Dimethyl-3-(3-cyclopropylmethoxy-3-oxo-1-propenyl)-cyclopropane-carboxylate
- IUPAC
- 3-[3-(cyclopropylmethoxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
Names & synonyms
IGUWGEBAHCMQSS-UHFFFAOYSA-M2,2-dimethyl-3-(3-cyclopropylmethoxy-3-oxo-1-propenyl)-cyclopropane-carboxylate
Database identifiers
- PubChem CID
- 73675573
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- -1
- Complexity
- 360
Related reactions
6 records
Compound notes
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