ChemSpider 2D Image | 2,3-Dihydroxy(~2~H_5_)propyl (9Z)-9-octadecenoate | C21H35D5O4

2,3-Dihydroxy(2H5)propyl (9Z)-9-octadecenoate

  • Molecular FormulaC21H35D5O4
  • Average mass361.571 Da
  • Monoisotopic mass361.324036 Da
  • ChemSpider ID30773450

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

(9Z)-9-Octadécénoate de 2,3-dihydroxy(2H5)propyle [French] [ACD/IUPAC Name]
2,3-Dihydroxy(2H5)propyl (9Z)-9-octadecenoate [ACD/IUPAC Name]
2,3-Dihydroxy(2H5)propyl-(9Z)-9-octadecenoat [German] [ACD/IUPAC Name]
9-Octadecenoic acid, 2,3-dihydroxypropyl-1,1,2,3,3-d5 ester, (9Z)- [ACD/Index Name]
(?)-1-Monoolein
(?)-Glyceryl 1-(cis-9-octadecenoate)
(?)-Glyceryl-1,1,2,3,3-d5 1-Monooleate
(±)-Glyceryl-1,1,2,3,3-d5 1-Monooleate
(1,1,2,3,3-pentadeuterio-2,3-dihydroxypropyl) (Z)-octadec-9-enoate
1-MONOOLEIN
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 483.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 86.2±6.0 kJ/mol
Flash Point: 155.4±19.4 °C
Index of Refraction: 1.479
Molar Refractivity: 104.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 6.59
ACD/BCF (pH 5.5): 60181.87
ACD/KOC (pH 5.5): 91774.66
ACD/LogD (pH 7.4): 6.59
ACD/BCF (pH 7.4): 60181.80
ACD/KOC (pH 7.4): 91774.55
Polar Surface Area: 67 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 367.7±3.0 cm3

Click to predict properties on the Chemicalize site


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