ChemSpider 2D Image | 4-(4-Chloro-1,3-thiazol-2-yl)-3-thiomorpholinecarboxylic acid | C8H9ClN2O2S2

4-(4-Chloro-1,3-thiazol-2-yl)-3-thiomorpholinecarboxylic acid

  • Molecular FormulaC8H9ClN2O2S2
  • Average mass264.752 Da
  • Monoisotopic mass263.979401 Da
  • ChemSpider ID46075848

More details:

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

3-Thiomorpholinecarboxylic acid, 4-(4-chloro-2-thiazolyl)- [ACD/Index Name]
4-(4-Chlor-1,3-thiazol-2-yl)-3-thiomorpholincarbonsäure [German] [ACD/IUPAC Name]
4-(4-Chloro-1,3-thiazol-2-yl)-3-thiomorpholinecarboxylic acid [ACD/IUPAC Name]
Acide 4-(4-chloro-1,3-thiazol-2-yl)-3-thiomorpholinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 488.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.5±3.0 kJ/mol
Flash Point: 249.3±31.5 °C
Index of Refraction: 1.661
Molar Refractivity: 62.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.86
ACD/LogD (pH 5.5): -0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 72.8±3.0 dyne/cm
Molar Volume: 168.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement