sodium;3-oxo-2-propylpentanoate


Chemical Name: sodium;3-oxo-2-propylpentanoate
CAS Number: 1184991-15-8
Product Number: AG008SPA(AGN-PC-07A21L)
Synonyms:
MDL No:
Molecular Formula: C8H13NaO3
Molecular Weight: 180.17679

Identification/Properties


Computed Properties
Molecular Weight:
180.179g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
180.076g/mol
Monoisotopic Mass:
180.076g/mol
Topological Polar Surface Area:
57.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
156
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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