ChemSpider 2D Image | 4-(1,3-Dioxolan-2-yl)-5-formyl-1,3-thiazole-2-carboxylic acid | C8H7NO5S

4-(1,3-Dioxolan-2-yl)-5-formyl-1,3-thiazole-2-carboxylic acid

  • Molecular FormulaC8H7NO5S
  • Average mass229.210 Da
  • Monoisotopic mass229.004486 Da
  • ChemSpider ID71090701

More details:

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

2-Thiazolecarboxylic acid, 4-(1,3-dioxolan-2-yl)-5-formyl- [ACD/Index Name]
4-(1,3-Dioxolan-2-yl)-5-formyl-1,3-thiazol-2-carbonsäure [German] [ACD/IUPAC Name]
4-(1,3-Dioxolan-2-yl)-5-formyl-1,3-thiazole-2-carboxylic acid [ACD/IUPAC Name]
Acide 4-(1,3-dioxolan-2-yl)-5-formyl-1,3-thiazole-2-carboxylique [French] [ACD/IUPAC Name]
2248388-93-2 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 476.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 241.9±31.5 °C
Index of Refraction: 1.648
Molar Refractivity: 51.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.93
ACD/LogD (pH 5.5): -2.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 114 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 82.2±3.0 dyne/cm
Molar Volume: 141.9±3.0 cm3

Click to predict properties on the Chemicalize site


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