Basic information
- Standard SMILES
CCOC(=O)C1(c2cccc(C=O)c2)CC1- InChIKey
HIFYXBUTNKSZFS-UHFFFAOYSA-N- Molecular formula
- C13H14O3
- Average molar mass
- 218.25 g/mol
Names & identifiers
- Preferred name
- Ethyl 1-(3-formylphenyl)cyclopropanecarboxylate
- IUPAC
- ethyl 1-(3-formylphenyl)cyclopropane-1-carboxylate
Names & synonyms
Ethyl 1-(3-formylphenyl)cyclopropanecarboxylateSCHEMBL15322131HIFYXBUTNKSZFS-UHFFFAOYSA-NDB-2085681469286-45-0
Database identifiers
- PubChem CID
- 89853850
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 281
Related reactions
1 records
Compound notes
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