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Search term: HMJIOKFBRSKMHO-SSDOTTSWSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | N-[(1R)-1-(2-Chlorophenyl)ethyl]methanesulfonamide | C9H12ClNO2S

N-[(1R)-1-(2-Chlorophenyl)ethyl]methanesulfonamide

  • Molecular FormulaC9H12ClNO2S
  • Average mass233.715 Da
  • Monoisotopic mass233.027725 Da
  • ChemSpider ID37319876
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

Methanesulfonamide, N-[(1R)-1-(2-chlorophenyl)ethyl]- [ACD/Index Name]
N-[(1R)-1-(2-Chlorophenyl)ethyl]methanesulfonamide [ACD/IUPAC Name]
N-[(1R)-1-(2-Chlorophényl)éthyl]méthanesulfonamide [French] [ACD/IUPAC Name]
N-[(1R)-1-(2-Chlorphenyl)ethyl]methansulfonamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 344.1±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.8±3.0 kJ/mol
Flash Point: 161.9±28.4 °C
Index of Refraction: 1.552
Molar Refractivity: 57.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 11.83
ACD/KOC (pH 5.5): 204.04
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.80
ACD/KOC (pH 7.4): 203.42
Polar Surface Area: 55 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 181.3±3.0 cm3

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