Basic information
- Standard SMILES
CC(C)(C)OC(=O)C=Cc1ccc(C=O)cc1- InChIKey
OFMQCKGSKVARCL-UHFFFAOYSA-N- Molecular formula
- C14H16O3
- Average molar mass
- 232.27 g/mol
Names & identifiers
- Preferred name
- 4-Formylcinnamic acid tert-butyl ester
- IUPAC
- tert-butyl 3-(4-formylphenyl)prop-2-enoate
Names & synonyms
SCHEMBL1322440OFMQCKGSKVARCL-UHFFFAOYSA-N4-formylcinnamic acid tert-butyl ester3-(4-formyl-phenyl)-acrylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 54147604
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 291
Related reactions
7 records
Compound notes
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