ChemSpider 2D Image | 1-[Isopropyl(methyl)amino]-3-(2-methoxy-4-{[methyl(2-methyl-2-propen-1-yl)amino]methyl}phenoxy)-2-propanol | C20H34N2O3

1-[Isopropyl(methyl)amino]-3-(2-methoxy-4-{[methyl(2-methyl-2-propen-1-yl)amino]methyl}phenoxy)-2-propanol

  • Molecular FormulaC20H34N2O3
  • Average mass350.496 Da
  • Monoisotopic mass350.256958 Da
  • ChemSpider ID22221319

More details:

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

1-[Isopropyl(methyl)amino]-3-(2-methoxy-4-{[methyl(2-methyl-2-propen-1-yl)amino]methyl}phenoxy)-2-propanol [ACD/IUPAC Name]
1-[Isopropyl(methyl)amino]-3-(2-methoxy-4-{[methyl(2-methyl-2-propen-1-yl)amino]methyl}phenoxy)-2-propanol [German] [ACD/IUPAC Name]
1-[Isopropyl(méthyl)amino]-3-(2-méthoxy-4-{[méthyl(2-méthyl-2-propén-1-yl)amino]méthyl}phénoxy)-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[2-methoxy-4-[[methyl(2-methyl-2-propen-1-yl)amino]methyl]phenoxy]-3-[methyl(1-methylethyl)amino]- [ACD/Index Name]
1-(2-METHOXY-4-{[METHYL(2-METHYLPROP-2-EN-1-YL)AMINO]METHYL}PHENOXY)-3-[METHYL(PROPAN-2-YL)AMINO]PROPAN-2-OL
1-[ISOPROPYL(METHYL)AMINO]-3-(2-METHOXY-4-{[METHYL(2-METHYLPROP-2-EN-1-YL)AMINO]METHYL}PHENOXY)PROPAN-2-OL

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

Density: 1.0±0.1 g/cm3
Boiling Point: 458.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 231.3±28.7 °C
Index of Refraction: 1.518
Molar Refractivity: 104.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): -1.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.59
Polar Surface Area: 45 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 36.5±3.0 dyne/cm
Molar Volume: 343.0±3.0 cm3

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