Hexanoic acid, 4-acetyl-5-oxo-, methyl ester


Chemical Name: Hexanoic acid, 4-acetyl-5-oxo-, methyl ester
CAS Number: 13984-53-7
Product Number: AG001BQY(AGN-PC-03FP5E)
Synonyms:
MDL No:
Molecular Formula: C9H14O4
Molecular Weight: 186.2051

Identification/Properties


Properties
BP:
279.7°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Refractive Index:
n20/D 1.459(lit.)
Computed Properties
Molecular Weight:
186.207g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
186.089g/mol
Monoisotopic Mass:
186.089g/mol
Topological Polar Surface Area:
60.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
206
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:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback