ChemSpider 2D Image | trans-3-Methyl-4-decanolide | C11H20O2

trans-3-Methyl-4-decanolide

  • Molecular FormulaC11H20O2
  • Average mass184.275 Da
  • Monoisotopic mass184.146332 Da
  • ChemSpider ID24765174
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(4S,5R)-5-Hexyl-4-methyldihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(4S,5R)-5-Hexyl-4-methyldihydro-2(3H)-furanone [ACD/IUPAC Name]
(4S,5R)-5-Hexyl-4-méthyldihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
(4S,5R)-trans-3-Methyl-4-decanolide
147254-33-9 [RN]
2(3H)-Furanone, 5-hexyldihydro-4-methyl-, (4S,5R)- [ACD/Index Name]
trans-3-methyl-?-decalactone
trans-3-Methyl-4-decanolide [Wiki]
UNII:XN9I5FD92J
XN9I5FD92J
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 275.4±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.4±3.0 kJ/mol
Flash Point: 110.1±15.9 °C
Index of Refraction: 1.441
Molar Refractivity: 52.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 122.67
ACD/KOC (pH 5.5): 1088.22
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 122.67
ACD/KOC (pH 7.4): 1088.22
Polar Surface Area: 26 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 28.7±3.0 dyne/cm
Molar Volume: 199.8±3.0 cm3

Click to predict properties on the Chemicalize site





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