ChemSpider 2D Image | 2-[(2-Hydroxy-2-phenylethyl)amino]-2-(~2~H_3_)methyl-1-(3,3,3-~2~H_3_)propanol | C12H13D6NO2

2-[(2-Hydroxy-2-phenylethyl)amino]-2-(2H3)methyl-1-(3,3,3-2H3)propanol

  • Molecular FormulaC12H13D6NO2
  • Average mass215.322 Da
  • Monoisotopic mass215.179245 Da
  • ChemSpider ID58782735

  • Non-standard isotope - Non-standard isotope

More details:

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

2-[(2-Hydroxy-2-phenylethyl)amino]-2-(2H3)methyl-1-(3,3,3-2H3)propanol [German] [ACD/IUPAC Name]
2-[(2-Hydroxy-2-phenylethyl)amino]-2-(2H3)methyl-1-(3,3,3-2H3)propanol [ACD/IUPAC Name]
2-[(2-Hydroxy-2-phényléthyl)amino]-2-(2H3)méthyl-1-(3,3,3-2H3)propanol [French] [ACD/IUPAC Name]
Benzenemethanol, α-[[[1-(hydroxymethyl)-1-(methyl-d3)ethyl-2,2,2-d3]amino]methyl]- [ACD/Index Name]
1346598-30-8 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 343.0±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.9±3.0 kJ/mol
Flash Point: 118.1±12.6 °C
Index of Refraction: 1.545
Molar Refractivity: 61.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.87
ACD/LogD (pH 5.5): -1.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.31
Polar Surface Area: 52 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 192.9±3.0 cm3

Click to predict properties on the Chemicalize site


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