ChemSpider 2D Image | 2,2-dichloro-N-[(2R)-3-fluoro-1-hydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide | C12H14Cl2FNO4S

2,2-dichloro-N-[(2R)-3-fluoro-1-hydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide

  • Molecular FormulaC12H14Cl2FNO4S
  • Average mass358.213 Da
  • Monoisotopic mass357.000458 Da
  • ChemSpider ID21470443

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

2,2-Dichlor-N-{(2R)-3-fluor-1-hydroxy-1-[4-(methylsulfonyl)phenyl]-2-propanyl}acetamid [German] [ACD/IUPAC Name]
2,2-dichloro-N-[(2R)-3-fluoro-1-hydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide
2,2-Dichloro-N-{(2R)-3-fluoro-1-hydroxy-1-[4-(methylsulfonyl)phenyl]-2-propanyl}acetamide [ACD/IUPAC Name]
2,2-Dichloro-N-{(2R)-3-fluoro-1-hydroxy-1-[4-(méthylsulfonyl)phényl]-2-propanyl}acétamide [French] [ACD/IUPAC Name]
Acetamide, 2,2-dichloro-N-[(1R)-1-(fluoromethyl)-2-hydroxy-2-[4-(methylsulfonyl)phenyl]ethyl]- [ACD/Index 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: 617.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.3±3.0 kJ/mol
Flash Point: 327.3±31.5 °C
Index of Refraction: 1.548
Molar Refractivity: 78.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.18
ACD/KOC (pH 5.5): 39.17
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.18
ACD/KOC (pH 7.4): 39.14
Polar Surface Area: 92 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 246.7±3.0 cm3

Click to predict properties on the Chemicalize site


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