ChemSpider 2D Image | 2-(3-Thienyl)-1,3-thiazole-5-carboxylic acid | C8H5NO2S2

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

  • Molecular FormulaC8H5NO2S2
  • Average mass211.261 Da
  • Monoisotopic mass210.976166 Da
  • ChemSpider ID26054204

More details:

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

1094385-75-7 [RN]
2-(3-Thienyl)-1,3-thiazol-5-carbonsäure [German] [ACD/IUPAC Name]
2-(3-Thienyl)-1,3-thiazole-5-carboxylic acid [ACD/IUPAC Name]
2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid
5-Thiazolecarboxylic acid, 2-(3-thienyl)- [ACD/Index Name]
Acide 2-(3-thiényl)-1,3-thiazole-5-carboxylique [French] [ACD/IUPAC Name]
MFCD11208448 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 443.3±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 221.9±30.4 °C
Index of Refraction: 1.679
Molar Refractivity: 52.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.97
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 69.9±3.0 dyne/cm
Molar Volume: 139.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement