ChemSpider 2D Image | (3S,6S)-3,6-Bis[(~13~C)methyl]-1,4-dioxane-2,5-dione | C413C2H8O4

(3S,6S)-3,6-Bis[(13C)methyl]-1,4-dioxane-2,5-dione

  • Molecular FormulaC413C2H8O4
  • Average mass146.111 Da
  • Monoisotopic mass146.048965 Da
  • ChemSpider ID58785665

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3S,6S)-3,6-Bis[(13C)methyl]-1,4-dioxan-2,5-dion [German] [ACD/IUPAC Name]
(3S,6S)-3,6-Bis[(13C)methyl]-1,4-dioxane-2,5-dione [ACD/IUPAC Name]
(3S,6S)-3,6-Bis[(13C)méthyl]-1,4-dioxane-2,5-dione [French] [ACD/IUPAC Name]
1,4-Dioxane-2,5-dione, 3,6-di(methyl-13C)-, (3S,6S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.429
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 31.4±3.0 dyne/cm
Molar Volume: 121.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement