ChemSpider 2D Image | N-Acetyl-3-sulfo-L-alanine | C5H9NO6S

N-Acetyl-3-sulfo-L-alanine

  • Molecular FormulaC5H9NO6S
  • Average mass211.193 Da
  • Monoisotopic mass211.015060 Da
  • ChemSpider ID57551124

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Alanine, N-acetyl-3-sulfo- [ACD/Index Name]
N-Acetyl-3-sulfo-L-alanin [German] [ACD/IUPAC Name]
N-Acetyl-3-sulfo-L-alanine [ACD/IUPAC Name]
N-Acétyl-3-sulfo-L-alanine [French] [ACD/IUPAC Name]
(R)-2-Acetamido-3-sulfopropanoic acid
79560-92-2 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.540
Molar Refractivity: 40.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.55
ACD/LogD (pH 5.5): -7.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 74.2±3.0 dyne/cm
Molar Volume: 130.5±3.0 cm3

Click to predict properties on the Chemicalize site


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