ChemSpider 2D Image | THPTA | C18H30N10O3

THPTA

  • Molecular FormulaC18H30N10O3
  • Average mass434.496 Da
  • Monoisotopic mass434.250244 Da
  • ChemSpider ID26669096

More details:

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

1H-1,2,3-Triazole-1-propanol, 4,4',4''-[nitrilotris(methylene)]tris- [ACD/Index Name]
3,3',3''-(4,4',4''-(Nitrilotris(methylene))tris(1H-1,2,3-triazole-4,1-diyl))tris(propan-1-ol)
3,3',3''-[nitrilotris(Methanediyl-1h-1,2,3-Triazole-4,1-Diyl)]tripropan-1-Ol
3,3',3''-[Nitrilotris(methylen-1H-1,2,3-triazol-4,1-diyl)]tri(1-propanol) [German] [ACD/IUPAC Name]
3,3',3''-[Nitrilotris(methylene-1H-1,2,3-triazole-4,1-diyl)]tri(1-propanol) [ACD/IUPAC Name]
3,3',3''-[Nitrilotris(méthylène-1H-1,2,3-triazole-4,1-diyl)]tri(1-propanol) [French] [ACD/IUPAC Name]
760952-88-3 [RN]
MFCD27665386
THPTA
tris(3-hydroxypropyltriazolylmethyl)amine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 723.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.0±3.0 kJ/mol
Flash Point: 391.5±35.7 °C
Index of Refraction: 1.690
Molar Refractivity: 114.6±0.5 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: -3.38
ACD/LogD (pH 5.5): -1.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.11
ACD/LogD (pH 7.4): -1.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.11
Polar Surface Area: 156 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 66.7±7.0 dyne/cm
Molar Volume: 299.9±7.0 cm3

Click to predict properties on the Chemicalize site


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