ChemSpider 2D Image | 1-(Benzyloxy)-3-[(2,3-dimethoxybenzyl)(3-methylbutyl)amino]-2-propanol | C24H35NO4

1-(Benzyloxy)-3-[(2,3-dimethoxybenzyl)(3-methylbutyl)amino]-2-propanol

  • Molecular FormulaC24H35NO4
  • Average mass401.539 Da
  • Monoisotopic mass401.256622 Da
  • ChemSpider ID22625463

More details:

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

1-(Benzyloxy)-3-[(2,3-dimethoxybenzyl)(3-methylbutyl)amino]-2-propanol [ACD/IUPAC Name]
1-(Benzyloxy)-3-[(2,3-dimethoxybenzyl)(3-methylbutyl)amino]-2-propanol [German] [ACD/IUPAC Name]
1-(Benzyloxy)-3-[(2,3-diméthoxybenzyl)(3-méthylbutyl)amino]-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[[(2,3-dimethoxyphenyl)methyl](3-methylbutyl)amino]-3-(phenylmethoxy)- [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: 518.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 267.2±30.1 °C
Index of Refraction: 1.540
Molar Refractivity: 117.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 5.85
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 9.71
ACD/KOC (pH 5.5): 47.16
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 420.30
ACD/KOC (pH 7.4): 2042.15
Polar Surface Area: 51 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 374.9±3.0 cm3

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