ChemSpider 2D Image | METHIONINAMIDE (S,S)-DIOXIDE | C5H12N2O3S

METHIONINAMIDE (S,S)-DIOXIDE

  • Molecular FormulaC5H12N2O3S
  • Average mass180.225 Da
  • Monoisotopic mass180.056870 Da
  • ChemSpider ID32697548

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Amino-4-(methylsulfonyl)butanamid [German] [ACD/IUPAC Name]
(2S)-2-Amino-4-(methylsulfonyl)butanamide [ACD/IUPAC Name]
(2S)-2-Amino-4-(méthylsulfonyl)butanamide [French] [ACD/IUPAC Name]
140171-14-8 [RN]
Butanamide, 2-amino-4-(methylsulfonyl)-, (2S)- [ACD/Index Name]
METHIONINAMIDE (S,S)-DIOXIDE
(S)-2-Amino-4-(methylsulfonyl)butanamide
MFCD20710519

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

0O58LJI3XN [DBID]
UNII:0O58LJI3XN [DBID]
UNII-0O58LJI3XN [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 476.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.0±3.0 kJ/mol
Flash Point: 241.9±27.3 °C
Index of Refraction: 1.516
Molar Refractivity: 41.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.22
ACD/LogD (pH 5.5): -2.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.62
Polar Surface Area: 112 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 137.0±3.0 cm3

Click to predict properties on the Chemicalize site


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