ChemSpider 2D Image | 2-{[3-(Dimethylamino)-2-hydroxypropyl]amino}-2-(hydroxymethyl)-1,3-propanediol | C9H22N2O4

2-{[3-(Dimethylamino)-2-hydroxypropyl]amino}-2-(hydroxymethyl)-1,3-propanediol

  • Molecular FormulaC9H22N2O4
  • Average mass222.282 Da
  • Monoisotopic mass222.157959 Da
  • ChemSpider ID55902761

More details:

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

1,3-Propanediol, 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]-2-(hydroxymethyl)- [ACD/Index Name]
2-{[3-(Dimethylamino)-2-hydroxypropyl]amino}-2-(hydroxymethyl)-1,3-propandiol [German] [ACD/IUPAC Name]
2-{[3-(Dimethylamino)-2-hydroxypropyl]amino}-2-(hydroxymethyl)-1,3-propanediol [ACD/IUPAC Name]
2-{[3-(Diméthylamino)-2-hydroxypropyl]amino}-2-(hydroxyméthyl)-1,3-propanediol [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 426.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.6±6.0 kJ/mol
Flash Point: 211.5±28.7 °C
Index of Refraction: 1.535
Molar Refractivity: 57.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -0.62
ACD/LogD (pH 5.5): -4.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 183.6±3.0 cm3

Click to predict properties on the Chemicalize site


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