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Search term: GDLXQEKNJMCXRS-LJQANCHMSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2R)-2,3-Bis(octyloxy)propyl dihydrogen phosphate | C19H41O6P

(2R)-2,3-Bis(octyloxy)propyl dihydrogen phosphate

  • Molecular FormulaC19H41O6P
  • Average mass396.499 Da
  • Monoisotopic mass396.264069 Da
  • ChemSpider ID23266026

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2,3-Bis(octyloxy)propyl dihydrogen phosphate [ACD/IUPAC Name]
(2R)-2,3-Bis(octyloxy)propyldihydrogenphosphat [German] [ACD/IUPAC Name]
1-Propanol, 2,3-bis(octyloxy)-, dihydrogen phosphate, (2R)- [ACD/Index Name]
Dihydrogénophosphate de (2R)-2,3-bis(octyloxy)propyle [French] [ACD/IUPAC Name]
(R)-2,3-bis(octyloxy)propyl dihydrogen phosphate
CHEMBL202243

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

Density: 1.0±0.1 g/cm3
Boiling Point: 509.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 85.4±6.0 kJ/mol
Flash Point: 262.0±32.9 °C
Index of Refraction: 1.465
Molar Refractivity: 105.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 5.85
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 3.77
ACD/KOC (pH 5.5): 10.16
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.18
Polar Surface Area: 95 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 38.7±3.0 dyne/cm
Molar Volume: 380.8±3.0 cm3

Click to predict properties on the Chemicalize site


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