Asparagine (data page)

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The complete data for Asparagine

Image:Hight_setter_449px.gifChemical structure of Asparagine 3D structure of Asparagine		 General information

Chemical formula: C4H8N2O3 
Molar mass: 132.118 g·mol-1
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@@H](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/A  CAS: [70-47-3]  DrugBank: N/A  EINECS: 200-735-9  PubChem: 6267 (L) [1]
Physical properties
Structure
 Crystal data
 Spectral data
UV-Vis
 IR
 NMR
 MS
Phase behavior
 Solid properties
Tm: 235 °C
 Liquid properties
Gas properties
Hazard properties
MSDS N/A Main hazards:
- N/A
 NFPA 704
 Flash point
- N/A
 R/S statement
R: N/A
S: N/A
 RTECS number:
N/A
Chemical properties
XLogP: -3.952 pI: 5.41 pKa: 2.16; 8.73 Tautomers: 2 Hydrogen bond: donor - 3;   acceptor - 4;
Pharmacological properties
Except where noted otherwise, data are given for materials in their standard state (at 25 °C, 100 kPa)


[edit] References

  1. a  CID 6267 from PubChem (L-asparagine)
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