Basic information
- Standard SMILES
C=CCOc1ccc(CCNC(=O)OC(C)(C)C)cc1- InChIKey
OSXZWKHSZVPIFN-UHFFFAOYSA-N- Molecular formula
- C16H23NO3
- Average molar mass
- 277.36 g/mol
- Monoisotopic mass
- 277.1677936
Names & identifiers
- Preferred name
- tert-Butyl{2-[4-(allyloxy)phenyl]ethyl}carbamate
- IUPAC
- tert-butyl N-[2-(4-prop-2-enoxyphenyl)ethyl]carbamate
Names & synonyms
SCHEMBL97962OSXZWKHSZVPIFN-UHFFFAOYSA-Ntert-Butyl{2-[4-(allyloxy)phenyl]ethyl}carbamatetert-Butyl {2-[4-(allyloxy)phenyl]ethyl}carbamate
Database identifiers
- PubChem CID
- 57933192
- Nikkaji
- J3.678.071A
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 301
Related reactions
2 records
Compound notes
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