ChemSpider 2D Image | 1-({(E)-[(1Z)-1-(Hydroxyimino)-1-nitro-2-propanylidene]amino}oxy)ethanone | C5H7N3O5

1-({(E)-[(1Z)-1-(Hydroxyimino)-1-nitro-2-propanylidene]amino}oxy)ethanone

  • Molecular FormulaC5H7N3O5
  • Average mass189.126 Da
  • Monoisotopic mass189.038574 Da
  • ChemSpider ID62894002

  • Double-bond stereo - Double-bond stereo

More details:

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

1-({(E)-[(1Z)-1-(Hydroxyimino)-1-nitro-2-propanyliden]amino}oxy)ethanon [German] [ACD/IUPAC Name]
1-({(E)-[(1Z)-1-(Hydroxyimino)-1-nitro-2-propanylidene]amino}oxy)ethanone [ACD/IUPAC Name]
1-({(E)-[(1Z)-1-(Hydroxyimino)-1-nitro-2-propanylidène]amino}oxy)éthanone [French] [ACD/IUPAC Name]
1,2-Propanedione, 1-nitro-, 2-(O-acetyloxime) 1-oxime, (1Z,2E)- [ACD/Index Name]
108560-94-7 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 347.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 68.5±6.0 kJ/mol
Flash Point: 164.0±23.2 °C
Index of Refraction: 1.543
Molar Refractivity: 40.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.35
ACD/LogD (pH 5.5): -1.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 56.0±7.0 dyne/cm
Molar Volume: 127.2±7.0 cm3

Click to predict properties on the Chemicalize site


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