ChemSpider 2D Image | Nitro(2-thienyl)methanone | C5H3NO3S

Nitro(2-thienyl)methanone

  • Molecular FormulaC5H3NO3S
  • Average mass157.147 Da
  • Monoisotopic mass156.983368 Da
  • ChemSpider ID67030424

More details:

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

Methanone, nitro-2-thienyl- [ACD/Index Name]
Nitro(2-thienyl)methanon [German] [ACD/IUPAC Name]
Nitro(2-thienyl)methanone [ACD/IUPAC Name]
Nitro(2-thiényl)méthanone [French] [ACD/IUPAC Name]
nitroformylthiophene

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

Density: 1.5±0.1 g/cm3
Boiling Point: 304.2±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.5±3.0 kJ/mol
Flash Point: 137.8±25.7 °C
Index of Refraction: 1.591
Molar Refractivity: 36.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 3.19
ACD/KOC (pH 5.5): 79.89
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 3.19
ACD/KOC (pH 7.4): 79.89
Polar Surface Area: 91 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 106.7±3.0 cm3

Click to predict properties on the Chemicalize site


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