ChemSpider 2D Image | 3-({2-[3-(1-Azocanyl)-2-hydroxypropoxy]-4-methoxybenzyl}amino)-2,2-dimethyl-1-propanol | C23H40N2O4

3-({2-[3-(1-Azocanyl)-2-hydroxypropoxy]-4-methoxybenzyl}amino)-2,2-dimethyl-1-propanol

  • Molecular FormulaC23H40N2O4
  • Average mass408.575 Da
  • Monoisotopic mass408.298798 Da
  • ChemSpider ID22217198

More details:

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

1(2H)-Azocineethanol, hexahydro-α-[[2-[[(3-hydroxy-2,2-dimethylpropyl)amino]methyl]-5-methoxyphenoxy]methyl]- [ACD/Index Name]
3-({2-[3-(1-Azocanyl)-2-hydroxypropoxy]-4-methoxybenzyl}amino)-2,2-dimethyl-1-propanol [ACD/IUPAC Name]
3-({2-[3-(1-Azocanyl)-2-hydroxypropoxy]-4-methoxybenzyl}amino)-2,2-dimethyl-1-propanol [German] [ACD/IUPAC Name]
3-({2-[3-(1-Azocanyl)-2-hydroxypropoxy]-4-méthoxybenzyl}amino)-2,2-diméthyl-1-propanol [French] [ACD/IUPAC 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: 572.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 299.8±30.1 °C
Index of Refraction: 1.526
Molar Refractivity: 117.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): -0.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.05
Polar Surface Area: 74 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 382.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement