ChemSpider 2D Image | N-(Isopropylsulfamoyl)-L-isoleucine | C9H20N2O4S

N-(Isopropylsulfamoyl)-L-isoleucine

  • Molecular FormulaC9H20N2O4S
  • Average mass252.331 Da
  • Monoisotopic mass252.114380 Da
  • ChemSpider ID50838513

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Isoleucine, N-[[(1-methylethyl)amino]sulfonyl]- [ACD/Index Name]
N-(Isopropylsulfamoyl)-L-isoleucin [German] [ACD/IUPAC Name]
N-(Isopropylsulfamoyl)-L-isoleucine [ACD/IUPAC Name]
N-(Isopropylsulfamoyl)-L-isoleucine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 388.7±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.0±6.0 kJ/mol
Flash Point: 188.9±28.4 °C
Index of Refraction: 1.492
Molar Refractivity: 61.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): -1.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 211.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement