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


Chemical Name: 1,4-Dioxane-2,5-dione, 3,6-dimethyl-, (3S,6S)-
CAS Number: 4511-42-6
Product Number: AG00353T(AGN-PC-0OAHU9)
Synonyms:
MDL No:
Molecular Formula: C6H8O4
Molecular Weight: 144.1253

Identification/Properties


Properties
MP:
92-94 °C(lit.);
BP:
285.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Moisture Sensitive
Refractive Index:
1.4475
Solubility:
Soluble in chloroform, and methanol. Slightly soluble in benzene.
Computed Properties
Molecular Weight:
144.126g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
144.042g/mol
Monoisotopic Mass:
144.042g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
155
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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


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