[5-Methoxy-2-(2-oxo-butyl)-phenyl]-carbamic acid t-butyl Ester
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Basic information
- Standard SMILES
CCC(=O)Cc1ccc(OC)cc1NC(=O)OC(C)(C)C- InChIKey
DKMIBBCPXXRUNX-UHFFFAOYSA-N- Molecular formula
- C16H23NO4
- Average molar mass
- 293.36 g/mol
Names & identifiers
- Preferred name
- [5-Methoxy-2-(2-oxo-butyl)-phenyl]-carbamic acid t-butyl Ester
- IUPAC
- tert-butyl N-[5-methoxy-2-(2-oxobutyl)phenyl]carbamate
Names & synonyms
SCHEMBL5241843DKMIBBCPXXRUNX-UHFFFAOYSA-N[5-Methoxy-2-(2-oxo-butyl)-phenyl]-carbamic acid t-butyl Ester
Database identifiers
- PubChem CID
- 20767945
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 362
Related reactions
5 records
Compound notes
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