ChemSpider 2D Image | 3,4-dehydrothiomorpholine-3-carboxylate | C5H6NO2S

3,4-dehydrothiomorpholine-3-carboxylate

  • Molecular FormulaC5H6NO2S
  • Average mass144.172 Da
  • Monoisotopic mass144.012466 Da
  • ChemSpider ID20476528

  • Charge - Charge

More details:

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

2H-1,4-Thiazine-3-carboxylato, 5,6-dihydro-, ion(1-) [ACD/Index Name]
3,4-dehydro-1,4-thiomorpholine-3-carboxylate
3,4-dehydrothiomorpholine-3-carboxylate
3,4-dehydro-thiomorpholine-3-carboxylate
5,6-Dihydro-2H-1,4-thiazin-3-carboxylat [German] [ACD/IUPAC Name]
5,6-Dihydro-2H-1,4-thiazine-3-carboxylate [ACD/IUPAC Name]
5,6-Dihydro-2H-1,4-thiazine-3-carboxylate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 342.3±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 64.4±6.0 kJ/mol
Flash Point: 160.8±30.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.33
ACD/LogD (pH 5.5): -2.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement