ChemSpider 2D Image | N-(4-Iodo-2-methylphenyl)-7a-methyl-5-oxohexahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide | C15H17IN2O2S

N-(4-Iodo-2-methylphenyl)-7a-methyl-5-oxohexahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide

  • Molecular FormulaC15H17IN2O2S
  • Average mass416.277 Da
  • Monoisotopic mass416.005524 Da
  • ChemSpider ID31350984

More details:

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

N-(4-Iod-2-methylphenyl)-7a-methyl-5-oxohexahydropyrrolo[2,1-b][1,3]thiazol-3-carboxamid [German] [ACD/IUPAC Name]
N-(4-Iodo-2-methylphenyl)-7a-methyl-5-oxohexahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide [ACD/IUPAC Name]
N-(4-Iodo-2-méthylphényl)-7a-méthyl-5-oxohexahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide [French] [ACD/IUPAC Name]
Pyrrolo[2,1-b]thiazole-3-carboxamide, hexahydro-N-(4-iodo-2-methylphenyl)-7a-methyl-5-oxo- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 576.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 302.3±30.1 °C
Index of Refraction: 1.694
Molar Refractivity: 93.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 101.17
ACD/KOC (pH 5.5): 948.02
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 101.17
ACD/KOC (pH 7.4): 948.02
Polar Surface Area: 75 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 65.3±5.0 dyne/cm
Molar Volume: 242.3±5.0 cm3

Click to predict properties on the Chemicalize site


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