ChemSpider 2D Image | 2-Heptadecylidene-4-hexadecyloxetan-3-one | C36H68O2

2-Heptadecylidene-4-hexadecyloxetan-3-one

  • Molecular FormulaC36H68O2
  • Average mass532.924 Da
  • Monoisotopic mass532.521912 Da
  • ChemSpider ID17215693

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-Heptadecyliden-4-hexadecyl-3-oxetanon [German] [ACD/IUPAC Name]
(2E)-2-Heptadecylidene-4-hexadecyl-3-oxetanone [ACD/IUPAC Name]
(2E)-2-Heptadécylidène-4-hexadécyl-3-oxêtanone [French] [ACD/IUPAC Name]
(2E)-2-heptadecylidene-4-hexadecyloxetan-3-one
2-Heptadecylidene-4-hexadecyloxetan-3-one
3-Oxetanone, 2-heptadecylidene-4-hexadecyl-, (2E)- [ACD/Index Name]
94109-14-5 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 612.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 174.9±19.5 °C
Index of Refraction: 1.487
Molar Refractivity: 170.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 30
#Rule of 5 Violations: 2
ACD/LogP: 16.23
ACD/LogD (pH 5.5): 15.49
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.49
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 67.4±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 592.0±3.0 cm3

Click to predict properties on the Chemicalize site


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