ChemSpider 2D Image | MFCD00673577 | C36H68O2

MFCD00673577

  • Molecular FormulaC36H68O2
  • Average mass532.924 Da
  • Monoisotopic mass532.521912 Da
  • ChemSpider ID4941106

  • Double-bond stereo - Double-bond stereo

More details:

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

(9Z,12Z)-9,12-Octadécadiénoate d'octadécyle [French] [ACD/IUPAC Name]
17673-53-9 [RN]
241-653-3 [EINECS]
9,12-Octadecadienoic acid, octadecyl ester, (9Z,12Z)- [ACD/Index Name]
MFCD00673577
Octadecyl (9Z,12Z)-9,12-octadecadienoate [ACD/IUPAC Name]
Octadecyl (9Z,12Z)-octadeca-9,12-dienoate
Octadecyl-(9Z,12Z)-9,12-octadecadienoat [German] [ACD/IUPAC Name]
(9Z,12Z)-octadeca-9,12-dienoic acid octadecyl ester
(9Z,12Z)-octadeca-9,12-dienoic acid stearyl ester
More...

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

6762ZSK8IM [DBID]
388335_ALDRICH [DBID]
BRN 1805188 [DBID]
C13821 [DBID]
LMFA07010001 [DBID]
P0169_SIGMA [DBID]
UNII:6762ZSK8IM [DBID]
UNII-6762ZSK8IM [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 590.8±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 54.0±22.6 °C
Index of Refraction: 1.469
Molar Refractivity: 170.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 32
#Rule of 5 Violations: 2
ACD/LogP: 16.67
ACD/LogD (pH 5.5): 15.10
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.10
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 67.7±0.5 10-24cm3
Surface Tension: 32.4±3.0 dyne/cm
Molar Volume: 613.5±3.0 cm3

Click to predict properties on the Chemicalize site


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