Phthalic acid, cyclobutyl ethyl ester
Basic information
- Standard SMILES
CCOC(=O)c1ccccc1C(=O)OC1CCC1- InChIKey
AHZOVQYJMCTOHT-UHFFFAOYSA-N- Molecular formula
- C14H16O4
- Average molar mass
- 248.27 g/mol
- Monoisotopic mass
- 248.10485899
Names & identifiers
- Preferred name
- Phthalic acid, cyclobutyl ethyl ester
- IUPAC
- 2-O-cyclobutyl 1-O-ethyl benzene-1,2-dicarboxylate
Names & synonyms
Phthalic acid, cyclobutyl ethyl esterAHZOVQYJMCTOHT-UHFFFAOYSA-NDTXSID301020991cyclobutyl ethyl benzene-1,2-dicarboxylate
Database identifiers
- PubChem CID
- 6423920
- DTXSID
DTXSID301020991
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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