ChemSpider 2D Image | 1-[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]-3-methylurea | C6H14N2O4

1-[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]-3-methylurea

  • Molecular FormulaC6H14N2O4
  • Average mass178.186 Da
  • Monoisotopic mass178.095352 Da
  • ChemSpider ID32389979

More details:

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

1-[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]-3-methylharnstoff [German] [ACD/IUPAC Name]
1-[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]-3-methylurea [ACD/IUPAC Name]
1-[1,3-Dihydroxy-2-(hydroxyméthyl)-2-propanyl]-3-méthylurée [French] [ACD/IUPAC Name]
Urea, N-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-N'-methyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 533.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.1±6.0 kJ/mol
Flash Point: 276.5±30.1 °C
Index of Refraction: 1.530
Molar Refractivity: 41.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.68
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.74
ACD/LogD (pH 7.4): -1.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.74
Polar Surface Area: 102 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 134.9±3.0 cm3

Click to predict properties on the Chemicalize site


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