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Search term: PXVAQENAIBBOHT-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | PROPANEDIOL DICAPRATE | C23H44O4

PROPANEDIOL DICAPRATE

  • Molecular FormulaC23H44O4
  • Average mass384.593 Da
  • Monoisotopic mass384.323975 Da
  • ChemSpider ID15077511

More details:

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

1,3-Propandiyl-didecanoat [German] [ACD/IUPAC Name]
1,3-Propanediyl didecanoate [ACD/IUPAC Name]
56519-72-3 [RN]
Decanoic acid, 1,3-propanediyl ester [ACD/Index Name]
Didécanoate de 1,3-propanediyle [French] [ACD/IUPAC Name]
PROPANEDIOL DICAPRATE
1118558-49-8 [RN]
3-decanoyloxypropyl decanoate
3-Octanoyloxypropyl octanoate
56519-71-2 [RN]
More...

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

5Q3540E9B5 [DBID]
UNII:5Q3540E9B5 [DBID]
UNII-5Q3540E9B5 [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: 464.7±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.6±3.0 kJ/mol
Flash Point: 218.2±19.6 °C
Index of Refraction: 1.453
Molar Refractivity: 112.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 1
ACD/LogP: 8.86
ACD/LogD (pH 5.5): 9.12
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2180254.50
ACD/LogD (pH 7.4): 9.12
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2180254.50
Polar Surface Area: 53 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 33.2±3.0 dyne/cm
Molar Volume: 415.2±3.0 cm3

Click to predict properties on the Chemicalize site


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