Butanoic acid, 3-methyl-2-oxo-, sodium salt


Chemical Name: Butanoic acid, 3-methyl-2-oxo-, sodium salt
CAS Number: 3715-29-5
Product Number: AG003UB5(AGN-PC-0RDBDE)
Synonyms:
MDL No:
Molecular Formula: C5H7NaO3
Molecular Weight: 138.0970

Identification/Properties


Properties
MP:
220-230 °C (dec.)(lit.)
BP:
170.2°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Solubility:
water: soluble100mg/mL, clear, colorless
Computed Properties
Molecular Weight:
138.098g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
138.029g/mol
Monoisotopic Mass:
138.029g/mol
Topological Polar Surface Area:
57.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
119
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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