ChemSpider 2D Image | 2,2',2''-Nitrilotri(~2~H_4_)ethanol | C6H3D12NO3

2,2',2''-Nitrilotri(2H4)ethanol

  • Molecular FormulaC6H3D12NO3
  • Average mass161.262 Da
  • Monoisotopic mass161.180511 Da
  • ChemSpider ID48063551
  • Non-standard isotope - Non-standard isotope


More details:






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

2,2',2''-Nitrilotri(2H4)ethanol [German] [ACD/IUPAC Name]
2,2',2''-Nitrilotri(2H4)ethanol [ACD/IUPAC Name]
2,2',2''-Nitrilotri(2H4)éthanol [French] [ACD/IUPAC Name]
Ethan-d4-ol, 2,2',2''-nitrilotris- [ACD/Index Name]
1469758-99-3 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 335.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 185.0±0.0 °C
Index of Refraction: 1.511
Molar Refractivity: 38.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.11
ACD/LogD (pH 5.5): -3.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.64
Polar Surface Area: 64 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 127.3±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement