ChemSpider 2D Image | 5-Bromo-4-methyl-3-nitro-2,3-dihydrothiophene 1,1-dioxide | C5H6BrNO4S

5-Bromo-4-methyl-3-nitro-2,3-dihydrothiophene 1,1-dioxide

  • Molecular FormulaC5H6BrNO4S
  • Average mass256.074 Da
  • Monoisotopic mass254.920090 Da
  • ChemSpider ID21107468

More details:

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

1,1-Dioxyde de 5-bromo-4-méthyl-3-nitro-2,3-dihydrothiophène [French] [ACD/IUPAC Name]
5-Brom-4-methyl-3-nitro-2,3-dihydrothiophen-1,1-dioxid [German] [ACD/IUPAC Name]
5-Bromo-4-methyl-3-nitro-2,3-dihydrothiophene 1,1-dioxide [ACD/IUPAC Name]
Thiophene, 5-bromo-2,3-dihydro-4-methyl-3-nitro-, 1,1-dioxide [ACD/Index Name]
2-bromo-3-methyl-4-nitro-2-thiolene 1,1-dioxide
330665-24-2 [RN]
5-Bromo-4-methyl-3-nitro-2,3-dihydro-1H-1λ6-thiophene-1,1-dione

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

Density: 1.9±0.1 g/cm3
Boiling Point: 474.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 240.7±28.7 °C
Index of Refraction: 1.598
Molar Refractivity: 45.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): -1.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 61.0±5.0 dyne/cm
Molar Volume: 132.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement