ChemSpider 2D Image | 2-Cyano-1,3-thiazole-5-carboxylic acid | C5H2N2O2S

2-Cyano-1,3-thiazole-5-carboxylic acid

  • Molecular FormulaC5H2N2O2S
  • Average mass154.147 Da
  • Monoisotopic mass153.983704 Da
  • ChemSpider ID26465596

More details:

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

2-Cyan-1,3-thiazol-5-carbonsäure [German] [ACD/IUPAC Name]
2-Cyano-1,3-thiazole-5-carboxylic acid [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-cyano- [ACD/Index Name]
Acide 2-cyano-1,3-thiazole-5-carboxylique [French] [ACD/IUPAC Name]
1167056-78-1 [RN]
1211527-90-0 [RN]
2-Cyano-thiazole-5-carboxylic acid
MFCD11845659

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

Density: 1.6±0.1 g/cm3
Boiling Point: 389.6±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 189.4±25.7 °C
Index of Refraction: 1.633
Molar Refractivity: 33.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.27
ACD/LogD (pH 5.5): -2.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 96.2±5.0 dyne/cm
Molar Volume: 93.8±5.0 cm3

Click to predict properties on the Chemicalize site


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