ChemSpider 2D Image | Methyl (5R)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate | C8H14O4

Methyl (5R)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate

  • Molecular FormulaC8H14O4
  • Average mass174.194 Da
  • Monoisotopic mass174.089203 Da
  • ChemSpider ID31044385

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(5R)-2,2,5-Triméthyl-1,3-dioxolane-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
1,3-Dioxolane-4-carboxylic acid, 2,2,5-trimethyl-, methyl ester, (5R)- [ACD/Index Name]
Methyl (5R)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate [ACD/IUPAC Name]
Methyl-(5R)-2,2,5-trimethyl-1,3-dioxolan-4-carboxylat [German] [ACD/IUPAC Name]
METHYL (4S)-TRANS-2,2,5-TRIMETHYL-1,3-DIOXOLANE-4-CARBOXYLATE

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

Density: 1.0±0.1 g/cm3
Boiling Point: 243.8±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.4 mmHg at 25°C
Enthalpy of Vaporization: 48.1±3.0 kJ/mol
Flash Point: 93.9±0.0 °C
Index of Refraction: 1.418
Molar Refractivity: 42.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 3.17
ACD/KOC (pH 5.5): 79.45
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 3.17
ACD/KOC (pH 7.4): 79.45
Polar Surface Area: 45 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 26.7±3.0 dyne/cm
Molar Volume: 166.8±3.0 cm3

Click to predict properties on the Chemicalize site


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