ChemSpider 2D Image | 2-[(2,2-Dimethoxyethyl)(2-hydroxy-3-methoxy-3-oxopropyl)amino]octanoic acid | C16H31NO7

2-[(2,2-Dimethoxyethyl)(2-hydroxy-3-methoxy-3-oxopropyl)amino]octanoic acid

  • Molecular FormulaC16H31NO7
  • Average mass349.420 Da
  • Monoisotopic mass349.210052 Da
  • ChemSpider ID102868492

More details:

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

2-[(2,2-Dimethoxyethyl)(2-hydroxy-3-methoxy-3-oxopropyl)amino]octanoic acid [ACD/IUPAC Name]
2-[(2,2-Dimethoxyethyl)(2-hydroxy-3-methoxy-3-oxopropyl)amino]octansäure [German] [ACD/IUPAC Name]
Acide 2-[(2,2-diméthoxyéthyl)(2-hydroxy-3-méthoxy-3-oxopropyl)amino]octanoïque [French] [ACD/IUPAC Name]
Octanoic acid, 2-[(2,2-dimethoxyethyl)(2-hydroxy-3-methoxy-3-oxopropyl)amino]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 478.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.6±6.0 kJ/mol
Flash Point: 243.1±28.7 °C
Index of Refraction: 1.482
Molar Refractivity: 88.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.09
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 106 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 42.3±3.0 dyne/cm
Molar Volume: 309.4±3.0 cm3

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