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Asparagine (data page)

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Chemical data page
The complete data for Asparagine ()
Chemical structure of Asparagine 3D structure of AsparagineGeneral informationChemical formula: C4H8N2O3
Molar mass: 132.118 g·mol
Systematic name:
(2S)-2-amino-3-carbamoyl-propanoic acid
Abbreviations: N, Asn
Synonyms:
(S)-2-aminosuccinic acid 4-amide
{α/2}-aminosuccinamic acid
Agedoite
Altheine
Asparagine acid
Asparamide
Asparatamine
Aspartamic acid
Aspartamine
Aspartic acid β-amide
Aspartic acid amide
CHEBI:17196
Crystal VI
NSC 82391
Database data
SMILES: C((C(=O)O)N)C(=O)N
InChI=1/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1/f/h8H,6H2
ATC: N/ACAS: DrugBank: N/AEINECS: 200-735-9PubChem: 6267 (L)
Physical properties
Structure
Crystal data
Spectral data
UV-Vis
IR
NMR
MS
- Masses of main fragments:
GMD MS Spectrum
Phase behavior
Solid properties
Tm: 235 °C
Liquid properties
Gas properties
Hazard properties
MSDS N/AMain hazards:- N/ANFPA 704Flash point- N/ARTECS number:
N/A
Chemical properties
XLogP: -3.952pI: 5.41pKa: 2.16; 8.73Tautomers: 2Hydrogen bond: donor - 3;  acceptor - 4
Pharmacological properties
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References

  1. ^a CID 6267 from PubChem (L-asparagine)
Encoded (proteinogenic) amino acids
General topics
Unspecified L-amino acid
By properties
Aliphatic
Aromatic
Polar, uncharged
Positive charge (pKa)
Negative charge (pKa)
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