ChemSpider 2D Image | 1-[(3,4-Dimethoxybenzyl)(propyl)amino]-3-isopropoxy-2-propanol | C18H31NO4

1-[(3,4-Dimethoxybenzyl)(propyl)amino]-3-isopropoxy-2-propanol

  • Molecular FormulaC18H31NO4
  • Average mass325.443 Da
  • Monoisotopic mass325.225311 Da
  • ChemSpider ID22624242

More details:

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

1-[(3,4-Dimethoxybenzyl)(propyl)amino]-3-isopropoxy-2-propanol [ACD/IUPAC Name]
1-[(3,4-Dimethoxybenzyl)(propyl)amino]-3-isopropoxy-2-propanol [German] [ACD/IUPAC Name]
1-[(3,4-Diméthoxybenzyl)(propyl)amino]-3-isopropoxy-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[[(3,4-dimethoxyphenyl)methyl]propylamino]-3-(1-methylethoxy)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 438.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 218.8±28.7 °C
Index of Refraction: 1.505
Molar Refractivity: 93.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.67
ACD/LogD (pH 5.5): 0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.34
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 27.24
ACD/KOC (pH 7.4): 283.20
Polar Surface Area: 51 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 36.5±3.0 dyne/cm
Molar Volume: 314.2±3.0 cm3

Click to predict properties on the Chemicalize site


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