ChemSpider 2D Image | 3-(Hydroxyamino)propanenitrile | C3H6N2O

3-(Hydroxyamino)propanenitrile

  • Molecular FormulaC3H6N2O
  • Average mass86.092 Da
  • Monoisotopic mass86.048012 Da
  • ChemSpider ID30776018

More details:

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

3-(Hydroxyamino)propanenitrile [ACD/IUPAC Name]
3-(Hydroxyamino)propanenitrile [French] [ACD/IUPAC Name]
3-(Hydroxyamino)propannitril [German] [ACD/IUPAC Name]
Propanenitrile, 3-(hydroxyamino)- [ACD/Index Name]
69622-86-2 [RN]
methyl 4-hydroxy-5-oxo-1-(pyridin-2-ylmethyl)-2,5-dihydro-1H-pyrrole-3-carboxylate
MFCD27939563

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

Density: 1.1±0.1 g/cm3
Boiling Point: 296.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.2±6.0 kJ/mol
Flash Point: 132.8±27.9 °C
Index of Refraction: 1.452
Molar Refractivity: 21.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.83
ACD/LogD (pH 5.5): -0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.98
ACD/LogD (pH 7.4): -0.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.27
Polar Surface Area: 56 Å2
Polarizability: 8.3±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 77.8±3.0 cm3

Click to predict properties on the Chemicalize site


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