ChemSpider 2D Image | Hexadecyl (2S)-2-ethylhexanoate | C24H48O2

Hexadecyl (2S)-2-ethylhexanoate

  • Molecular FormulaC24H48O2
  • Average mass368.637 Da
  • Monoisotopic mass368.365417 Da
  • ChemSpider ID34988610

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Éthylhexanoate d'hexadécyle [French] [ACD/IUPAC Name]
Hexadecyl (2S)-2-ethylhexanoate [ACD/IUPAC Name]
Hexadecyl-(2S)-2-ethylhexanoat [German] [ACD/IUPAC Name]
Hexanoic acid, 2-ethyl-, hexadecyl ester, (2S)- [ACD/Index Name]
261-619-1 [EINECS]
59130-69-7 [RN]
CETEARYL ETHYLHEXANOATE
CETYL ETHYLHEXANOATE
UNII-134647WMX4
UNII-9M64UO4C25

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

Density: 0.9±0.1 g/cm3
Boiling Point: 407.2±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 203.7±9.7 °C
Index of Refraction: 1.449
Molar Refractivity: 115.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 1
ACD/LogP: 11.15
ACD/LogD (pH 5.5): 10.37
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.37
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 30.7±3.0 dyne/cm
Molar Volume: 428.6±3.0 cm3

Click to predict properties on the Chemicalize site


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