ChemSpider 2D Image | (2S)-1-Hydroxy-3-(tetradecanoyloxy)-2-propanyl (9Z)-9-tetradecenoate | C31H58O5

(2S)-1-Hydroxy-3-(tetradecanoyloxy)-2-propanyl (9Z)-9-tetradecenoate

  • Molecular FormulaC31H58O5
  • Average mass510.789 Da
  • Monoisotopic mass510.428436 Da
  • ChemSpider ID24765843
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2S)-1-Hydroxy-3-(tetradecanoyloxy)-2-propanyl (9Z)-9-tetradecenoate [ACD/IUPAC Name]
(2S)-1-Hydroxy-3-(tetradecanoyloxy)-2-propanyl-(9Z)-9-tetradecenoat [German] [ACD/IUPAC Name]
(9Z)-9-Tétradécénoate de (2S)-1-hydroxy-3-(tetradecanoyloxy)-2-propanyle [French] [ACD/IUPAC Name]
9-Tetradecenoic acid, (1S)-2-hydroxy-1-[[(1-oxotetradecyl)oxy]methyl]ethyl ester, (9Z)- [ACD/Index Name]
(2S)-1-hydroxy-3-(tetradecanoyloxy)propan-2-yl (9Z)-tetradec-9-enoate
1-Myristoyl-2-myristoleoyl-sn-glycerol
DAG(14:0/14:1)
DAG(14:0/14:1n5)
DAG(14:0/14:1w5)
DAG(28:1)
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 583.9±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.2±6.0 kJ/mol
Flash Point: 170.2±15.3 °C
Index of Refraction: 1.472
Molar Refractivity: 150.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 11.70
ACD/LogD (pH 5.5): 10.63
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.63
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 538.7±3.0 cm3

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