2-METHOXYCARBONYLCYCLOHEXANONE


Chemical Name: 2-METHOXYCARBONYLCYCLOHEXANONE
CAS Number: 41302-34-5
Product Number: AG003HJX(AGN-PC-0WAFW3)
Synonyms:
MDL No:
Molecular Formula: C8H12O3
Molecular Weight: 156.1791

Identification/Properties


Properties
BP:
230.8°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Refractive Index:
n20/D 1.483
Computed Properties
Molecular Weight:
156.181g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
156.079g/mol
Monoisotopic Mass:
156.079g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
174
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:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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