ethyl (2S)-2-amino-3-ethoxypropanoate
Basic information
- CAS
779286-98-5- Standard SMILES
CCOC[C@H](N)C(=O)OCC- InChIKey
GTRWSXKMZCUUBI-LURJTMIESA-N- Molecular formula
- C7H15NO3
- Average molar mass
- 161.2 g/mol
Names & identifiers
- Preferred name
- ethyl (2S)-2-amino-3-ethoxypropanoate
- IUPAC
- ethyl (2S)-2-amino-3-ethoxypropanoate
- English name
- Serine, O-ethyl-, ethyl ester (9CI)
- Molecular formula
- C7H15NO3
- Molecular weight
- 161.2
Names & synonyms
442199-73-7ethyl (2S)-2-amino-3-ethoxypropanoateSCHEMBL10682835EN300-648548Serine, O-ethyl-, ethyl esterSerine, O-ethyl-, ethyl ester (9CI)
Database identifiers
- CAS
779286-98-5
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- Boiling point
- 234.6 · 234.6±20.0 °C(Predicted)
- Density
- 1.02 · 1.020±0.06 g/cm3(Predicted)
- pka
- 6.31 · 6.31±0.33(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…