ChemSpider 2D Image | N-({2-[(4-Sulfophenyl)sulfonyl]ethoxy}carbonyl)-L-leucine | C15H21NO9S2

N-({2-[(4-Sulfophenyl)sulfonyl]ethoxy}carbonyl)-L-leucine

  • Molecular FormulaC15H21NO9S2
  • Average mass423.458 Da
  • Monoisotopic mass423.065765 Da
  • ChemSpider ID57557009

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-LEUCINE, N-[[2-[(4-SULFOPHENYL)SULFONYL]ETHOXY]CARBONYL]- [ACD/Index Name]
N-({2-[(4-Sulfophenyl)sulfonyl]ethoxy}carbonyl)-L-leucin [German] [ACD/IUPAC Name]
N-({2-[(4-Sulfophenyl)sulfonyl]ethoxy}carbonyl)-L-leucine [ACD/IUPAC Name]
N-({2-[(4-Sulfophényl)sulfonyl]éthoxy}carbonyl)-L-leucine [French] [ACD/IUPAC Name]
(S)-4-Methyl-2-(((2-((4-sulfophenyl)sulfonyl)ethoxy)carbonyl)amino)pentanoic acid
821791-99-5 [RN]
N-{[2-(4-Sulfobenzene-1-sulfonyl)ethoxy]carbonyl}-L-leucine

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.558
Molar Refractivity: 94.7±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 1.23
ACD/LogD (pH 5.5): -4.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 181 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 58.0±3.0 dyne/cm
Molar Volume: 293.7±3.0 cm3

Click to predict properties on the Chemicalize site


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