ChemSpider 2D Image | 1-[(2,3-Dimethoxybenzyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)-2-propanol | C24H35NO5

1-[(2,3-Dimethoxybenzyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)-2-propanol

  • Molecular FormulaC24H35NO5
  • Average mass417.538 Da
  • Monoisotopic mass417.251526 Da
  • ChemSpider ID22625465

More details:






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

1-[(2,3-Dimethoxybenzyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)-2-propanol [ACD/IUPAC Name]
1-[(2,3-Dimethoxybenzyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)-2-propanol [German] [ACD/IUPAC Name]
1-[(2,3-Diméthoxybenzyl)(3-méthylbutyl)amino]-3-(4-méthoxyphénoxy)-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[[(2,3-dimethoxyphenyl)methyl](3-methylbutyl)amino]-3-(4-methoxyphenoxy)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 544.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 283.1±30.1 °C
Index of Refraction: 1.536
Molar Refractivity: 119.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 6.83
ACD/KOC (pH 5.5): 38.60
ACD/LogD (pH 7.4): 3.62
ACD/BCF (pH 7.4): 275.85
ACD/KOC (pH 7.4): 1559.31
Polar Surface Area: 60 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 39.4±3.0 dyne/cm
Molar Volume: 383.7±3.0 cm3

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