ChemSpider 2D Image | 4-Nitrophenyl 2-chloroethanesulfonate | C8H8ClNO5S

4-Nitrophenyl 2-chloroethanesulfonate

  • Molecular FormulaC8H8ClNO5S
  • Average mass265.671 Da
  • Monoisotopic mass264.981171 Da
  • ChemSpider ID35776192

More details:

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

2-Chloroéthanesulfonate de 4-nitrophényle [French] [ACD/IUPAC Name]
4-Nitrophenyl 2-chloroethanesulfonate [ACD/IUPAC Name]
4-Nitrophenyl-2-chlorethansulfonat [German] [ACD/IUPAC Name]
Ethanesulfonic acid, 2-chloro-, 4-nitrophenyl ester [ACD/Index Name]
4-Nitrophenyl 2-chloroethane-1-sulfonate
61980-91-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 439.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.9±3.0 kJ/mol
Flash Point: 219.3±28.7 °C
Index of Refraction: 1.573
Molar Refractivity: 57.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 1.95
ACD/BCF (pH 5.5): 17.85
ACD/KOC (pH 5.5): 273.83
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 17.85
ACD/KOC (pH 7.4): 273.83
Polar Surface Area: 98 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 174.2±3.0 cm3

Click to predict properties on the Chemicalize site


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