Basic information
- Standard SMILES
CC(C)COC(=O)C=CC1C(C(=O)[O-])C1(C)C- InChIKey
ZIDVVPGXZMJAHF-UHFFFAOYSA-M- Molecular formula
- C13H19O4-
- Average molar mass
- 239.29 g/mol
Names & identifiers
- Preferred name
- 2,2-Dimethyl-3-(3-isobutoxy-3-oxo-1-propenyl)-cyclopropane-carboxylate
- IUPAC
- 2,2-dimethyl-3-[3-(2-methylpropoxy)-3-oxoprop-1-enyl]cyclopropane-1-carboxylate
Names & synonyms
ZIDVVPGXZMJAHF-UHFFFAOYSA-M2,2-dimethyl-3-(3-isobutoxy-3-oxo-1-propenyl)-cyclopropane-carboxylate
Database identifiers
- PubChem CID
- 73675575
Properties
Computed structural properties
- XLogP
- 3.1
- 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
- 336
Related reactions
1 records
Compound notes
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