ChemSpider 2D Image | 5-Methylthiazole-4-carbonitrile | C5H4N2S

5-Methylthiazole-4-carbonitrile

  • Molecular FormulaC5H4N2S
  • Average mass124.164 Da
  • Monoisotopic mass124.009521 Da
  • ChemSpider ID27756295

More details:

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

1187942-88-6 [RN]
4-Thiazolecarbonitrile, 5-methyl- [ACD/Index Name]
5-Methyl-1,3-thiazol-4-carbonitril [German] [ACD/IUPAC Name]
5-Methyl-1,3-thiazole-4-carbonitrile [ACD/IUPAC Name]
5-Méthyl-1,3-thiazole-4-carbonitrile [French] [ACD/IUPAC Name]
5-Methylthiazole-4-carbonitrile
MFCD20924502

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

Density: 1.3±0.1 g/cm3
Boiling Point: 240.1±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.7±3.0 kJ/mol
Flash Point: 99.0±21.8 °C
Index of Refraction: 1.559
Molar Refractivity: 31.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.04
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 49.39
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.63
ACD/KOC (pH 7.4): 49.39
Polar Surface Area: 65 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 57.2±5.0 dyne/cm
Molar Volume: 98.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement