Basic information
- Standard SMILES
CC(C)(C)OC(=O)C=Cc1ccccc1- InChIKey
AGKLVMVJXDFIGC-UHFFFAOYSA-N- Molecular formula
- C13H16O2
- Average molar mass
- 204.26 g/mol
- Monoisotopic mass
- 204.11502975
Names & identifiers
- Preferred name
- Tert-butyl cinnamate
- IUPAC
- tert-butyl 3-phenylprop-2-enoate
Names & synonyms
tert-Butyl cinnamateRefChem:932753tert-butylcinnamate2-Propenoic acid, 3-phenyl-, 1,1-dimethylethyl estert-butyl cinnamate2-Propenoic acid, 3-phenyl-, 1,1-dimethylethyl ester, (E)-tert-Butyl 3-phenylacrylatetert-butyl 3-phenylprop-2-enoatetert-Butyl trans-cinnamateSCHEMBL1006098t-butyl 3-phenylprop-2-enoateSCHEMBL27577452
Show more names
AGKLVMVJXDFIGC-UHFFFAOYSA-NTERT-BUTYL CINNAMATE 98(E)-Cinnamic acid tert-butyl esterJZ3015AKOS030240818TERT-BUTYL CINNAMATE, 99.5%(E)-Benzeneacrylic acid tert-butyl esterDB-257042
Database identifiers
- PubChem CID
- 347555
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 229
Related reactions
8 records
Compound notes
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