2-Cyclohexene-1,4-dione, 2,6,6-trimethyl-


Chemical Name: 2-Cyclohexene-1,4-dione, 2,6,6-trimethyl-
CAS Number: 1125-21-9
Product Number: AG007T3Q(AGN-PC-0JL4Z2)
Synonyms:
MDL No:
Molecular Formula: C9H12O2
Molecular Weight: 152.1904

Identification/Properties


Computed Properties
Molecular Weight:
152.193g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
152.084g/mol
Monoisotopic Mass:
152.084g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
246
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

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NMR Spectrum


Other Analytical Data


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