ChemSpider 2D Image | (2S)-2-Amino-4-(S-propylsulfonimidoyl)butanoic acid | C7H16N2O3S

(2S)-2-Amino-4-(S-propylsulfonimidoyl)butanoic acid

  • Molecular FormulaC7H16N2O3S
  • Average mass208.279 Da
  • Monoisotopic mass208.088165 Da
  • ChemSpider ID57533770

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2S)-2-Amino-4-(S-propylsulfonimidoyl)butanoic acid [ACD/IUPAC Name]
(2S)-2-Amino-4-(S-propylsulfonimidoyl)butansäure [German] [ACD/IUPAC Name]
Acide (2S)-2-amino-4-(S-propylsulfonimidoyl)butanoïque [French] [ACD/IUPAC Name]
BUTANOIC ACID, 2-AMINO-4-(S-PROPYLSULFONIMIDOYL)-, (2S)- [ACD/Index Name]
(2S)-2-Amino-4-(propylsulfonimidoyl)butanoic acid
(2S)-2-Amino-4-[S-(propane-1-)sulfonimidoyl]butanoic acid
156714-62-4 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 371.3±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 67.9±6.0 kJ/mol
Flash Point: 178.3±30.7 °C
Index of Refraction: 1.543
Molar Refractivity: 49.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.31
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 113 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 155.5±7.0 cm3

Click to predict properties on the Chemicalize site


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