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Search term: 114826534 (Found by CSID)
ChemSpider 2D Image | 2-(1H-Indol-3-ylcarbonyl)-4-thiazolecarboxylic acid | C13H8N2O3S

2-(1H-Indol-3-ylcarbonyl)-4-thiazolecarboxylic acid

  • Molecular FormulaC13H8N2O3S
  • Average mass272.279 Da
  • Monoisotopic mass272.025574 Da
  • ChemSpider ID114826534

More details:

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

2-(1H-Indol-3-ylcarbonyl)-1,3-thiazol-4-carbonsäure [German] [ACD/IUPAC Name]
2-(1H-Indol-3-ylcarbonyl)-1,3-thiazole-4-carboxylic acid [ACD/IUPAC Name]
2-(1H-Indol-3-ylcarbonyl)-4-thiazolecarboxylic acid
4-Thiazolecarboxylic acid, 2-(1H-indol-3-ylcarbonyl)- [ACD/Index Name]
951207-88-8 [RN]
2-(1H-Indole-3-carbonyl)thiazole-4-carboxylic acid
2-[(1H-Indole-3-yl)carbonyl]thiazole-4-carboxylic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 598.7±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 315.9±29.6 °C
Index of Refraction: 1.755
Molar Refractivity: 71.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): -0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.07
ACD/LogD (pH 7.4): -0.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 111 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 83.6±3.0 dyne/cm
Molar Volume: 175.2±3.0 cm3

Click to predict properties on the Chemicalize site


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