ChemSpider 2D Image | 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-bis[(~2~H_3_)methyl]butanamide | C9H13D6NO4

2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-bis[(2H3)methyl]butanamide

  • Molecular FormulaC9H13D6NO4
  • Average mass211.288 Da
  • Monoisotopic mass211.169067 Da
  • ChemSpider ID107436839
  • Non-standard isotope - Non-standard isotope


More details:






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

2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-bis[(2H3)methyl]butanamid [German] [ACD/IUPAC Name]
2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-bis[(2H3)methyl]butanamide [ACD/IUPAC Name]
2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-bis[(2H3)méthyl]butanamide [French] [ACD/IUPAC Name]
Butanamide-4,4,4-d3, 2-hydroxy-3-(hydroxymethyl)-N-(3-hydroxypropyl)-3-(methyl-d3)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 483.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 86.3±6.0 kJ/mol
Flash Point: 246.3±28.7 °C
Index of Refraction: 1.502
Molar Refractivity: 51.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.92
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.66
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.66
Polar Surface Area: 90 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 176.0±3.0 cm3

Click to predict properties on the Chemicalize site






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