ChemSpider 2D Image | 2-(1,1-Difluoroethyl)-1,3-thiazole-5-carboxylic acid | C6H5F2NO2S

2-(1,1-Difluoroethyl)-1,3-thiazole-5-carboxylic acid

  • Molecular FormulaC6H5F2NO2S
  • Average mass193.171 Da
  • Monoisotopic mass193.000900 Da
  • ChemSpider ID45465891

More details:

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

2-(1,1-Difluorethyl)-1,3-thiazol-5-carbonsäure [German] [ACD/IUPAC Name]
2-(1,1-Difluoroethyl)-1,3-thiazole-5-carboxylic acid [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-(1,1-difluoroethyl)- [ACD/Index Name]
Acide 2-(1,1-difluoroéthyl)-1,3-thiazole-5-carboxylique [French] [ACD/IUPAC Name]
1785611-30-4 [RN]
2-(1,1-difluoroethyl)-1,3-thiazole-5-carboxylicacid
MFCD28555847

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

Density: 1.5±0.1 g/cm3
Boiling Point: 279.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.7±3.0 kJ/mol
Flash Point: 122.8±27.3 °C
Index of Refraction: 1.517
Molar Refractivity: 39.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): -0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 129.2±3.0 cm3

Click to predict properties on the Chemicalize site


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