ChemSpider 2D Image | (Nitroamino)acetonitrile | C2H3N3O2

(Nitroamino)acetonitrile

  • Molecular FormulaC2H3N3O2
  • Average mass101.064 Da
  • Monoisotopic mass101.022530 Da
  • ChemSpider ID75538442

More details:

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

(Nitroamino)acetonitril [German] [ACD/IUPAC Name]
(Nitroamino)acetonitrile [ACD/IUPAC Name]
(Nitroamino)acétonitrile [French] [ACD/IUPAC Name]
Acetonitrile, 2-(nitroamino)- [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: 281.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.0±3.0 kJ/mol
Flash Point: 123.8±27.9 °C
Index of Refraction: 1.457
Molar Refractivity: 20.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.70
ACD/LogD (pH 5.5): -1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.00
ACD/LogD (pH 7.4): -2.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 82 Å2
Polarizability: 8.3±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 76.5±3.0 cm3

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