Basic information
- CAS
24184-58-5- Standard SMILES
CCOC(=O)[C@@H](N)CC(N)=O- InChIKey
ZTCCUHKCQDSJPK-BYPYZUCNSA-N- Molecular formula
- C6H12N2O3
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.08479225
Names & identifiers
- Preferred name
- Ethyl L-asparaginate
- IUPAC
- ethyl (2S)-2,4-diamino-4-oxobutanoate
- English name
- ethyl L-asparaginate
- Molecular formula
- C6H12N2O3
- Molecular weight
- 160.17
Names & synonyms
Ethyl L-asparaginate24184-58-5ETHYL (2S)-2-AMINO-3-CARBAMOYLPROPANOATEethyl (2S)-2,4-diamino-4-oxobutanoateAsparagine, ethyl esterEINECS 246-068-7SCHEMBL1178957DTXSID60178890ZTCCUHKCQDSJPK-BYPYZUCNSA-NNS00027582EN300-7696591Asparagine ethyl ester
Show more names
L-Asparagine ethyl ester
Database identifiers
- CAS
24184-58-5- PubChem CID
- 90388
- DTXSID
DTXSID60178890- EC Number
- 246-068-7
- Nikkaji
- J281.644J
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 95.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 158
Physicochemical properties
- Boiling point
- 335.5 · 335.5±32.0 °C(Predicted)
- Density
- 1.178 · 1.178±0.06 g/cm3(Predicted)
- pka
- 16.03 · 16.03±0.40(Predicted)
Chemistry & industry
Suppliers2 total
CHEMSTEP[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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