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3715-29-5,MFCD00002581
Catalog No.:AA003U8D

3715-29-5 | Sodium 3-methyl-2-oxobutanoate

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250mg
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$13.00   $9.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003U8D
Chemical Name:
Sodium 3-methyl-2-oxobutanoate
CAS Number:
3715-29-5
Molecular Formula:
C5H7NaO3
Molecular Weight:
138.0970
MDL Number:
MFCD00002581
SMILES:
CC(C(=O)C(=O)[O-])C.[Na+]
Properties
Properties
 
BP:
170.2°C at 760 mmHg  
Form:
Solid  
MP:
220-230 °C (dec.)(lit.)  
Solubility:
water: soluble100mg/mL, clear, colorless  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
119  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  

Upstream Synthesis Route

[1]HelveticaChimicaActa,1982,vol.65,#7,p.2024-2028

Downstream Synthesis Route

[1]HelveticaChimicaActa,1982,vol.65,p.2024-2028

[1]JournalofOrganicChemistry,1993,vol.58,p.6920-6921

[1]Tetrahedron,1991,vol.47,p.1411-1416

[1]TetrahedronLetters,1991,vol.32,p.3623-3626

[1]ChemistryLetters,1982,p.1765-1768

Literature

Title: MAAS WK, et al. alpha-Ketoisovaleric acid, a precursor of pantothenic acid in Escherichia coli. J Bacteriol. 1953 Apr;65(4):388-93.

Title: Schauder P, et al. Oral administration of alpha-ketoisovaleric acid or valine in humans: blood kinetics and biochemical effects. J Lab Clin Med. 1984 Apr;103(4):597-605.

Title: Coitinho AS, et al. Pharmacological evidence that alpha-ketoisovaleric acid induces convulsions through GABAergic and glutamatergic mechanisms in rats. Brain Res. 2001 Mar 9;894(1):68-73.

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SDS
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