ChemSpider 2D Image | 2-amino-N-[(1,1-dioxo-1??-thiolan-3-yl)methyl]propanamide | C8H16N2O3S

2-amino-N-[(1,1-dioxo-1??-thiolan-3-yl)methyl]propanamide

  • Molecular FormulaC8H16N2O3S
  • Average mass220.289 Da
  • Monoisotopic mass220.088165 Da
  • ChemSpider ID31035969

More details:

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

1218639-75-8 [RN]
2-amino-N-[(1,1-dioxo-1??-thiolan-3-yl)methyl]propanamide
N-[(1,1-Dioxidotetrahydro-3-thiophenyl)methyl]alaninamid [German] [ACD/IUPAC Name]
N-[(1,1-Dioxidotetrahydro-3-thiophenyl)methyl]alaninamide [ACD/IUPAC Name]
N-[(1,1-Dioxydotétrahydro-3-thiophényl)méthyl]alaninamide [French] [ACD/IUPAC Name]
Propanamide, 2-amino-N-[(tetrahydro-1,1-dioxido-3-thienyl)methyl]- [ACD/Index Name]
2-amino-N-[(1,1-dioxo-1λ6-thiolan-3-yl)methyl]propanamide
2-amino-N-[(1,1-dioxo-1λ6-thiolan-3-yl)methyl]propanamide
MFCD12780363

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

Density: 1.3±0.1 g/cm3
Boiling Point: 515.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.6±23.2 °C
Index of Refraction: 1.517
Molar Refractivity: 53.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.41
ACD/LogD (pH 5.5): -4.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 175.9±3.0 cm3

Click to predict properties on the Chemicalize site


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