ChemSpider 2D Image | N-Cyclopropyl-4-hydroxy-N-[(2R)-2-hydroxy-2-phenylpropyl]benzenesulfonamide | C18H21NO4S

N-Cyclopropyl-4-hydroxy-N-[(2R)-2-hydroxy-2-phenylpropyl]benzenesulfonamide

  • Molecular FormulaC18H21NO4S
  • Average mass347.429 Da
  • Monoisotopic mass347.119141 Da
  • ChemSpider ID26636816
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

Benzenesulfonamide, N-cyclopropyl-4-hydroxy-N-[(2R)-2-hydroxy-2-phenylpropyl]- [ACD/Index Name]
N-Cyclopropyl-4-hydroxy-N-[(2R)-2-hydroxy-2-phenylpropyl]benzenesulfonamide [ACD/IUPAC Name]
N-Cyclopropyl-4-hydroxy-N-[(2R)-2-hydroxy-2-phénylpropyl]benzènesulfonamide [French] [ACD/IUPAC Name]
N-Cyclopropyl-4-hydroxy-N-[(2R)-2-hydroxy-2-phenylpropyl]benzolsulfonamid [German] [ACD/IUPAC Name]
N-Cyclopropyl-4-Oxidanyl-N-[(2r)-2-Oxidanyl-2-Phenyl-Propyl]benzenesulfonamide
SU4

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 562.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 294.1±32.9 °C
Index of Refraction: 1.663
Molar Refractivity: 93.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 185.37
ACD/KOC (pH 5.5): 1460.63
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 139.06
ACD/KOC (pH 7.4): 1095.76
Polar Surface Area: 86 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 68.1±5.0 dyne/cm
Molar Volume: 251.0±5.0 cm3

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