ChemSpider 2D Image | (4S,4'R,5R)-5-[(31-Dotriaconten-1-yloxy)methyl]-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxolane | C43H82O5

(4S,4'R,5R)-5-[(31-Dotriaconten-1-yloxy)methyl]-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxolane

  • Molecular FormulaC43H82O5
  • Average mass679.108 Da
  • Monoisotopic mass678.616211 Da
  • ChemSpider ID8803673

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(4S,4'R,5R)-5-[(31-Dotriaconten-1-yloxy)methyl]-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxolan [German] [ACD/IUPAC Name]
(4S,4'R,5R)-5-[(31-Dotriaconten-1-yloxy)methyl]-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxolane [ACD/IUPAC Name]
(4S,4'R,5R)-5-[(31-Dotriacontén-1-yloxy)méthyl]-2,2,2',2'-tétraméthyl-4,4'-bi-1,3-dioxolane [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 680.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.3±3.0 kJ/mol
Flash Point: 225.6±30.0 °C
Index of Refraction: 1.465
Molar Refractivity: 205.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 34
#Rule of 5 Violations: 2
ACD/LogP: 17.58
ACD/LogD (pH 5.5): 14.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.99
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 46 Å2
Polarizability: 81.3±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 742.8±3.0 cm3

Click to predict properties on the Chemicalize site


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