ChemSpider 2D Image | N-[(2S)-2-Hydroxypropyl]-1-butanesulfonamide | C7H17NO3S

N-[(2S)-2-Hydroxypropyl]-1-butanesulfonamide

  • Molecular FormulaC7H17NO3S
  • Average mass195.280 Da
  • Monoisotopic mass195.092911 Da
  • ChemSpider ID40819436
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1-Butanesulfonamide, N-[(2S)-2-hydroxypropyl]- [ACD/Index Name]
N-[(2S)-2-Hydroxypropyl]-1-butanesulfonamide [ACD/IUPAC Name]
N-[(2S)-2-Hydroxypropyl]-1-butanesulfonamide [French] [ACD/IUPAC Name]
N-[(2S)-2-Hydroxypropyl]-1-butansulfonamid [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 315.8±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.6±6.0 kJ/mol
Flash Point: 144.8±28.4 °C
Index of Refraction: 1.476
Molar Refractivity: 48.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.36
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.50
ACD/KOC (pH 5.5): 46.42
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.50
ACD/KOC (pH 7.4): 46.41
Polar Surface Area: 75 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 171.8±3.0 cm3

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