Jump to content

Aspartic acid (data page)

From Wikipedia, the free encyclopedia
The complete data for Aspartic acid ()
Chemical structure of Aspartic acidChemical structure of the amino acid aspartateGeneral information
Chemical formula: C4H7NO4 
Molar mass: 133.102 g·mol−1
Systematic name:
(2S)-2-aminobutanedioic acid
Synonyms:
AIDS{-}001654
AIDS001654
{(α/2)/(DL)}-aminosuccinic acid
(DL)-Asparagic acid
(DL)-Asparaginic acid
Aspartate
{(+-)/(DL)/(RS)}-Aspartic acid
CHEBI:22660
CHEMBANK2882
CPD-302
NSC141379
NSC167399
NSC3973
NSC620336
NSC79553
NSC97922
Spartase
Database data
SMILES: D - C([C@H](C(=O)O)N)C(=O)O; L - C([C@@H](C(=O)O)N)C(=O)O;
InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/f/h6,8H
 ATC: N/A CAS: [56-84-8] DrugBank: N/A EINECS: 200-291-6 PubChem:
83887 (D)a , 5960 (L)a
Physical properties
Structure
Crystal data
Spectral data
UV-Vis
IR
NMR
MS
- Masses of main fragments:
GMD MS Spectrum
Phase behavior
Solid properties
ρsolid: 1.66 g.cm−3
Tm: 270-271 °C
Liquid properties
Gas properties
Hazard properties
MSDS
N/A
Main hazards:
- N/A
NFPA 704Flash point
- N/A
RTECS number:
N/A
Chemical properties
XLogP: -3.236pI: 2.77pKa: 1.95; 3.71; 9.66Tautomers: Hydrogen bond: donor - 3;  acceptor - 5
Pharmacological properties
  This box:   

References

[edit]
  1. ^a CID 424 from PubChemracemic
  2. ^a CID 83887 from PubChem — (D-aspartic acid)
  3. ^a CID 5960 from PubChem — (L-aspartic acid)
  4. ^a CID 450566 from PubChem — C(C(C(=O)O)N)[11C](=O)O
  5. ^a CID 450604 from PubChem — C(C(C(=O)O)[13NH2])C(=O)O