Basic information
- Standard SMILES
CC(C)(C)OC(=O)C=Cc1ccccc1C(=O)O- InChIKey
GRRZQXQTAZAXTN-UHFFFAOYSA-N- Molecular formula
- C14H16O4
- Average molar mass
- 248.27 g/mol
- Monoisotopic mass
- 248.10485899
Names & identifiers
- Preferred name
- t-Butyl 3-(2-carboxyphenyl)acrylate
- IUPAC
- 2-[3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]benzoic acid
Names & synonyms
SCHEMBL6807802SCHEMBL29607568GRRZQXQTAZAXTN-UHFFFAOYSA-Nt-butyl 3-(2-carboxyphenyl)acrylate
Database identifiers
- PubChem CID
- 53853802
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 338
Related reactions
2 records
Compound notes
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