ChemSpider 2D Image | 2,2',2''-(1,2,4-Triazinane-1,2,4-triyl)triethanol | C9H21N3O3

2,2',2''-(1,2,4-Triazinane-1,2,4-triyl)triethanol

  • Molecular FormulaC9H21N3O3
  • Average mass219.281 Da
  • Monoisotopic mass219.158295 Da
  • ChemSpider ID28577307

More details:

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

1,2,4-Triazine-1,2,4(3H)-triethanol, dihydro- [ACD/Index Name]
2,2',2''-(1,2,4-Triazinan-1,2,4-triyl)triethanol [German] [ACD/IUPAC Name]
2,2',2''-(1,2,4-Triazinane-1,2,4-triyl)triethanol [ACD/IUPAC Name]
2,2',2''-(1,2,4-Triazinane-1,2,4-triyl)triéthanol [French] [ACD/IUPAC Name]
2,2',2''-(1,2,4-Triazinane-1,2,4-triyl)tri(ethan-1-ol)
917597-80-9 [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: 413.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.0±6.0 kJ/mol
Flash Point: 232.3±30.2 °C
Index of Refraction: 1.530
Molar Refractivity: 57.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -2.72
ACD/LogD (pH 5.5): -3.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.05
Polar Surface Area: 70 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 184.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement