ChemSpider 2D Image | 1,2-GLYCEROL DIERUCATE | C47H88O5

1,2-GLYCEROL DIERUCATE

  • Molecular FormulaC47H88O5
  • Average mass733.199 Da
  • Monoisotopic mass732.663147 Da
  • ChemSpider ID4942706

  • Double-bond stereo - Double-bond stereo

More details:

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

(13Z,13'Z)Bis(-13-docosénoate) de 3-hydroxy-1,2-propanediyle [French] [ACD/IUPAC Name]
1,2-GLYCEROL DIERUCATE
13-Docosenoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester, (13Z,13'Z)- [ACD/Index Name]
3-Hydroxy-1,2-propandiyl-(13Z,13'Z)bis(-13-docosenoat) [German] [ACD/IUPAC Name]
3-Hydroxy-1,2-propanediyl (13Z,13'Z)bis(-13-docosenoate) [ACD/IUPAC Name]
1,2-dierucin
1-[(13Z)-DOCOS-13-ENOYLOXY]-3-HYDROXYPROPAN-2-YL (13Z)-DOCOS-13-ENOATE
142735-73-7 [RN]
Bis((Z)-docos-13-enoic) acid, diester with glycerol
DIERUCIN
More...

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

0G2WFW0NU6 [DBID]
UNII:0G2WFW0NU6 [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: 738.3±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.9±6.0 kJ/mol
Flash Point: 195.0±17.2 °C
Index of Refraction: 1.477
Molar Refractivity: 225.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 44
#Rule of 5 Violations: 2
ACD/LogP: 19.68
ACD/LogD (pH 5.5): 17.22
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 17.22
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 89.2±0.5 10-24cm3
Surface Tension: 35.2±3.0 dyne/cm
Molar Volume: 796.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement