Found 1 result

Search term: 113158-69-3 (Found by approved synonym)
ChemSpider 2D Image | D-Buthionine-(S,R)-sulfoximine | C8H18N2O3S

D-Buthionine-(S,R)-sulfoximine

  • Molecular FormulaC8H18N2O3S
  • Average mass222.305 Da
  • Monoisotopic mass222.103806 Da
  • ChemSpider ID19335680

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R)-2-Amino-4-(S-butylsulfonimidoyl)butanoic acid [ACD/IUPAC Name]
(2R)-2-Amino-4-(S-butylsulfonimidoyl)butansäure [German] [ACD/IUPAC Name]
113158-69-3 [RN]
Acide (2R)-2-amino-4-(S-butylsulfonimidoyl)butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2-amino-4-(S-butylsulfonimidoyl)-, (2R)- [ACD/Index Name]
D-Buthionine-(S,R)-sulfoximine
[5072-26-4] [RN]
DL-Buthionine-(S,R)-sulfoximine
MFCD00070309 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 382.3±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 69.2±6.0 kJ/mol
Flash Point: 185.0±30.7 °C
Index of Refraction: 1.538
Molar Refractivity: 53.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.22
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: 21.3±0.5 10-24cm3
Surface Tension: 50.2±7.0 dyne/cm
Molar Volume: 171.7±7.0 cm3

Click to predict properties on the Chemicalize site


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