ChemSpider 2D Image | 3-[(3-Bromo-2-hydroxypropyl)(methyl)amino]-1-propanol | C7H16BrNO2

3-[(3-Bromo-2-hydroxypropyl)(methyl)amino]-1-propanol

  • Molecular FormulaC7H16BrNO2
  • Average mass226.111 Da
  • Monoisotopic mass225.036438 Da
  • ChemSpider ID111003151

More details:

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

1-Propanol, 3-[(3-bromo-2-hydroxypropyl)methylamino]- [ACD/Index Name]
3-[(3-Brom-2-hydroxypropyl)(methyl)amino]-1-propanol [German] [ACD/IUPAC Name]
3-[(3-Bromo-2-hydroxypropyl)(methyl)amino]-1-propanol [ACD/IUPAC Name]
3-[(3-Bromo-2-hydroxypropyl)(méthyl)amino]-1-propanol [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 329.6±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.3±6.0 kJ/mol
Flash Point: 153.1±25.1 °C
Index of Refraction: 1.524
Molar Refractivity: 49.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.25
ACD/LogD (pH 5.5): -2.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.05
Polar Surface Area: 44 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 159.9±3.0 cm3

Click to predict properties on the Chemicalize site


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