ChemSpider 2D Image | Methyl 3-(dichloroacetyl)-1,3-thiazolidine-2-carboxylate | C7H9Cl2NO3S

Methyl 3-(dichloroacetyl)-1,3-thiazolidine-2-carboxylate

  • Molecular FormulaC7H9Cl2NO3S
  • Average mass258.122 Da
  • Monoisotopic mass256.968018 Da
  • ChemSpider ID57454245

More details:

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

2-Thiazolidinecarboxylic acid, 3-(2,2-dichloroacetyl)-, methyl ester [ACD/Index Name]
3-(2,2-Dichloroacétyl)-1,3-thiazolidine-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-(dichloroacetyl)-1,3-thiazolidine-2-carboxylate [ACD/IUPAC Name]
Methyl-3-(dichloracetyl)-1,3-thiazolidin-2-carboxylat [German] [ACD/IUPAC Name]
2-THIAZOLIDINECARBOXYLIC ACID, 3-(DICHLOROACETYL)-, METHYL ESTER
88095-66-3 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 373.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.1±3.0 kJ/mol
Flash Point: 179.8±27.9 °C
Index of Refraction: 1.560
Molar Refractivity: 55.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.18
ACD/KOC (pH 5.5): 96.97
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 4.18
ACD/KOC (pH 7.4): 96.97
Polar Surface Area: 72 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 171.3±3.0 cm3

Click to predict properties on the Chemicalize site


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