ChemSpider 2D Image | 2-(2-Methyl-5-nitro-1-imidazolidinyl)ethanesulfonyl chloride | C6H12ClN3O4S

2-(2-Methyl-5-nitro-1-imidazolidinyl)ethanesulfonyl chloride

  • Molecular FormulaC6H12ClN3O4S
  • Average mass257.695 Da
  • Monoisotopic mass257.023712 Da
  • ChemSpider ID109724463

More details:

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

1-Imidazolidineethanesulfonyl chloride, 2-methyl-5-nitro- [ACD/Index Name]
2-(2-Methyl-5-nitro-1-imidazolidinyl)ethanesulfonyl chloride [ACD/IUPAC Name]
2-(2-Methyl-5-nitro-1-imidazolidinyl)ethansulfonylchlorid [German] [ACD/IUPAC Name]
Chlorure de 2-(2-méthyl-5-nitro-1-imidazolidinyl)éthanesulfonyle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 395.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.5±3.0 kJ/mol
Flash Point: 192.9±27.9 °C
Index of Refraction: 1.565
Molar Refractivity: 55.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.13
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.87
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.18
Polar Surface Area: 104 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 168.8±5.0 cm3

Click to predict properties on the Chemicalize site


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