ChemSpider 2D Image | 3-(Aminocarbonyl)-2,5-dihydro-2,2,5,5-tetra(methyl-d3)-1H-pyrrol-1-yloxy | C9H4D12N2O2

3-(Aminocarbonyl)-2,5-dihydro-2,2,5,5-tetra(methyl-d3)-1H-pyrrol-1-yloxy

  • Molecular FormulaC9H4D12N2O2
  • Average mass196.309 Da
  • Monoisotopic mass196.196503 Da
  • ChemSpider ID103870667

  • Non-standard isotope - Non-standard isotope

More details:

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

126657-37-2 [RN]
1H-Pyrrole-3-carboxamide, 2,5-dihydro-1-hydroxy-2,2,5,5-tetra(methyl-d3)- [ACD/Index Name]
1-Hydroxy-2,2,5,5-tetrakis[(2H3)methyl]-2,5-dihydro-1H-pyrrol-3-carboxamid [German] [ACD/IUPAC Name]
1-Hydroxy-2,2,5,5-tetrakis[(2H3)methyl]-2,5-dihydro-1H-pyrrole-3-carboxamide [ACD/IUPAC Name]
1-Hydroxy-2,2,5,5-tétrakis[(2H3)méthyl]-2,5-dihydro-1H-pyrrole-3-carboxamide [French] [ACD/IUPAC Name]
3-(Aminocarbonyl)-2,5-dihydro-2,2,5,5-tetra(methyl-d3)-1H-pyrrol-1-yloxy

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

Density: 1.1±0.1 g/cm3
Boiling Point: 353.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 65.8±6.0 kJ/mol
Flash Point: 167.7±27.9 °C
Index of Refraction: 1.524
Molar Refractivity: 50.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.30
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.07
ACD/LogD (pH 7.4): -0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.13
Polar Surface Area: 67 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 163.3±3.0 cm3

Click to predict properties on the Chemicalize site


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