ChemSpider 2D Image | 3-[(2-{3-[Cyclohexyl(methyl)amino]-2-hydroxypropoxy}benzyl)amino]-1-propanol | C20H34N2O3

3-[(2-{3-[Cyclohexyl(methyl)amino]-2-hydroxypropoxy}benzyl)amino]-1-propanol

  • Molecular FormulaC20H34N2O3
  • Average mass350.496 Da
  • Monoisotopic mass350.256958 Da
  • ChemSpider ID22132286

More details:

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

1-Propanol, 3-[[[2-[3-(cyclohexylmethylamino)-2-hydroxypropoxy]phenyl]methyl]amino]- [ACD/Index Name]
3-[(2-{3-[Cyclohexyl(methyl)amino]-2-hydroxypropoxy}benzyl)amino]-1-propanol [ACD/IUPAC Name]
3-[(2-{3-[Cyclohexyl(methyl)amino]-2-hydroxypropoxy}benzyl)amino]-1-propanol [German] [ACD/IUPAC Name]
3-[(2-{3-[Cyclohexyl(méthyl)amino]-2-hydroxypropoxy}benzyl)amino]-1-propanol [French] [ACD/IUPAC Name]
1-[CYCLOHEXYL(METHYL)AMINO]-3-(2-{[(3-HYDROXYPROPYL)AMINO]METHYL}PHENOXY)PROPAN-2-OL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 529.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 274.0±30.1 °C
Index of Refraction: 1.557
Molar Refractivity: 101.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): -2.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 65 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 49.4±5.0 dyne/cm
Molar Volume: 316.2±5.0 cm3

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