ChemSpider 2D Image | N-[1-Hydroxy-2-(hydroxymethyl)-2-butanyl]-4-iodobenzenesulfonamide | C11H16INO4S

N-[1-Hydroxy-2-(hydroxymethyl)-2-butanyl]-4-iodobenzenesulfonamide

  • Molecular FormulaC11H16INO4S
  • Average mass385.219 Da
  • Monoisotopic mass384.984467 Da
  • ChemSpider ID47601339

More details:






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

Benzenesulfonamide, N-[1,1-bis(hydroxymethyl)propyl]-4-iodo- [ACD/Index Name]
N-[1-Hydroxy-2-(hydroxymethyl)-2-butanyl]-4-iodbenzolsulfonamid [German] [ACD/IUPAC Name]
N-[1-Hydroxy-2-(hydroxymethyl)-2-butanyl]-4-iodobenzenesulfonamide [ACD/IUPAC Name]
N-[1-Hydroxy-2-(hydroxyméthyl)-2-butanyl]-4-iodobenzènesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 527.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 272.9±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 78.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.46
ACD/KOC (pH 5.5): 211.78
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.43
ACD/KOC (pH 7.4): 211.16
Polar Surface Area: 95 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 223.2±3.0 cm3

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