ChemSpider 2D Image | Trierucin | C69H128O6

Trierucin

  • Molecular FormulaC69H128O6
  • Average mass1053.751 Da
  • Monoisotopic mass1052.971069 Da
  • ChemSpider ID4575813

  • Double-bond stereo - Double-bond stereo

More details:

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

(13Z,13'Z,13''Z)Tris(-13-docosénoate) de 1,2,3-propanetriyle [French] [ACD/IUPAC Name]
1,2,3-Propanetriyl (13Z,13'Z,13''Z)tris(-13-docosenoate) [ACD/IUPAC Name]
1,2,3-Propantriyl-(13Z,13'Z,13''Z)tris(-13-docosenoat) [German] [ACD/IUPAC Name]
1,2,3-Tri-13(Z)-Docosenoyl Glycerol
13-Docosenoic acid, 1,2,3-propanetriyl ester, (13Z,13'Z,13''Z)- [ACD/Index Name]
220-399-7 [EINECS]
2752-99-0 [RN]
Glyceryl trierucate
Propane-1,2,3-triyl (13Z,13'Z,13''Z)tris-docos-13-enoate
Trierucin
More...

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

I0IDQ0M20R [DBID]
LMGL03012438 [DBID]
T9154_SIGMA [DBID]
UNII:I0IDQ0M20R [DBID]
UNII-I0IDQ0M20R [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: 909.6±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.3±3.0 kJ/mol
Flash Point: 322.0±25.2 °C
Index of Refraction: 1.476
Molar Refractivity: 327.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 65
#Rule of 5 Violations: 2
ACD/LogP: 30.09
ACD/LogD (pH 5.5): 27.68
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 27.68
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 129.7±0.5 10-24cm3
Surface Tension: 34.6±3.0 dyne/cm
Molar Volume: 1159.2±3.0 cm3

Click to predict properties on the Chemicalize site


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