ChemSpider 2D Image | 3-Hydroxy-1,2-propanediyl bis(9-octadecenoate) | C39H72O5

3-Hydroxy-1,2-propanediyl bis(9-octadecenoate)

  • Molecular FormulaC39H72O5
  • Average mass620.986 Da
  • Monoisotopic mass620.537964 Da
  • ChemSpider ID1284

More details:

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

3-Hydroxy-1,2-propandiyl-bis(9-octadecenoat) [German] [ACD/IUPAC Name]
3-Hydroxy-1,2-propanediyl bis(9-octadecenoate) [ACD/IUPAC Name]
9-Octadecenoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester [ACD/Index Name]
Bis(9-octadécénoate) de 3-hydroxy-1,2-propanediyle [French] [ACD/IUPAC Name]
2442-61-7 [RN]
3738-74-7 [RN]
3-hydroxypropane-1,2-diyl bisoctadec-9-enoate

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

Bio1_000178 [DBID]
Bio1_000667 [DBID]
Bio1_001156 [DBID]
Bio2_000013 [DBID]
Bio2_000493 [DBID]
CBiol_001892 [DBID]
KBio2_000013 [DBID]
KBio2_002581 [DBID]
KBio2_005149 [DBID]
KBio3_000025 [DBID]
More...

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

Density: 0.9±0.1 g/cm3
Boiling Point: 670.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 112.8±6.0 kJ/mol
Flash Point: 186.3±19.4 °C
Index of Refraction: 1.477
Molar Refractivity: 187.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 15.43
ACD/LogD (pH 5.5): 14.02
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.02
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 74.5±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 664.4±3.0 cm3

Click to predict properties on the Chemicalize site


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