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Search term: CXWGXWCRRRODLP (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1-(Nitroamino)acetone | C3H6N2O3

1-(Nitroamino)acetone

  • Molecular FormulaC3H6N2O3
  • Average mass118.091 Da
  • Monoisotopic mass118.037842 Da
  • ChemSpider ID24191938

More details:






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

1-(Nitroamino)aceton [German] [ACD/IUPAC Name]
1-(Nitroamino)acetone [ACD/IUPAC Name]
1-(Nitroamino)acétone [French] [ACD/IUPAC Name]
2-Propanone, 1-(nitroamino)- [ACD/Index Name]
1-(NITROAMINO)PROPAN-2-ONE
163936-88-7 [RN]
2-Propanone, 1-(nitroamino)- (9CI)

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

Density: 1.2±0.1 g/cm3
Boiling Point: 225.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.2±3.0 kJ/mol
Flash Point: 90.0±27.9 °C
Index of Refraction: 1.442
Molar Refractivity: 25.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.41
ACD/LogD (pH 5.5): -0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.79
ACD/LogD (pH 7.4): -2.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 10.1±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 96.8±3.0 cm3

Click to predict properties on the Chemicalize site






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