ChemSpider 2D Image | Nithiazine | C5H8N2O2S

Nithiazine

  • Molecular FormulaC5H8N2O2S
  • Average mass160.194 Da
  • Monoisotopic mass160.030655 Da
  • ChemSpider ID31106559

More details:

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

2-(Nitromethylen)-1,3-thiazinan [German] [ACD/IUPAC Name]
2-(Nitromethylene)-1,3-thiazinane [ACD/IUPAC Name]
2-(Nitrométhylène)-1,3-thiazinane [French] [ACD/IUPAC Name]
2H-1,3-Thiazine, tetrahydro-2-(nitromethylene)- [ACD/Index Name]
58842-20-9 [RN]
Nithiazine [ISO] [Wiki]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 287.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.7±3.0 kJ/mol
Flash Point: 127.9±27.3 °C
Index of Refraction: 1.652
Molar Refractivity: 42.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.34
ACD/LogD (pH 5.5): 0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.19
ACD/LogD (pH 7.4): 0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.19
Polar Surface Area: 83 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 115.4±3.0 cm3

Click to predict properties on the Chemicalize site


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