ChemSpider 2D Image | 1-Cyano-N-(4-fluorobenzyl)methanesulfonamide | C9H9FN2O2S

1-Cyano-N-(4-fluorobenzyl)methanesulfonamide

  • Molecular FormulaC9H9FN2O2S
  • Average mass228.243 Da
  • Monoisotopic mass228.036880 Da
  • ChemSpider ID34209135

More details:

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

1-Cyan-N-(4-fluorbenzyl)methansulfonamid [German] [ACD/IUPAC Name]
1-Cyano-N-(4-fluorobenzyl)methanesulfonamide [ACD/IUPAC Name]
1-Cyano-N-(4-fluorobenzyl)méthanesulfonamide [French] [ACD/IUPAC Name]
Methanesulfonamide, 1-cyano-N-[(4-fluorophenyl)methyl]- [ACD/Index Name]
1-cyano-N-[(4-fluorophenyl)methyl]methanesulfonamide
948910-03-0 [RN]
MFCD16109599

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

Density: 1.4±0.1 g/cm3
Boiling Point: 407.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 200.1±31.5 °C
Index of Refraction: 1.553
Molar Refractivity: 53.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.34
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.61
ACD/KOC (pH 5.5): 87.19
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 3.14
ACD/KOC (pH 7.4): 75.78
Polar Surface Area: 78 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 166.2±3.0 cm3

Click to predict properties on the Chemicalize site


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