1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(1-oxooctyl)-


Chemical Name: 1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(1-oxooctyl)-
CAS Number: 103576-44-9
Product Number: AG007XDG(AGN-PC-0JQCS9)
Synonyms:
MDL No:
Molecular Formula: C14H22O5
Molecular Weight: 270.3215

Identification/Properties


Computed Properties
Molecular Weight:
270.325g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
270.147g/mol
Monoisotopic Mass:
270.147g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
339
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


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