ChemSpider 2D Image | 2-Methyl-5-(1-naphthylamino)-3-oxo-2,3-dihydro-1,2-thiazole-4-carbonitrile | C15H11N3OS

2-Methyl-5-(1-naphthylamino)-3-oxo-2,3-dihydro-1,2-thiazole-4-carbonitrile

  • Molecular FormulaC15H11N3OS
  • Average mass281.332 Da
  • Monoisotopic mass281.062286 Da
  • ChemSpider ID21120869

More details:

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

2-Methyl-5-(1-naphthylamino)-3-oxo-2,3-dihydro-1,2-thiazol-4-carbonitril [German] [ACD/IUPAC Name]
2-Methyl-5-(1-naphthylamino)-3-oxo-2,3-dihydro-1,2-thiazole-4-carbonitrile [ACD/IUPAC Name]
2-Méthyl-5-(1-naphtylamino)-3-oxo-2,3-dihydro-1,2-thiazole-4-carbonitrile [French] [ACD/IUPAC Name]
4-Isothiazolecarbonitrile, 2,3-dihydro-2-methyl-5-(1-naphthalenylamino)-3-oxo- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 434.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.8±31.5 °C
Index of Refraction: 1.742
Molar Refractivity: 80.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 17.47
ACD/KOC (pH 5.5): 269.69
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 17.47
ACD/KOC (pH 7.4): 269.69
Polar Surface Area: 81 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 72.4±5.0 dyne/cm
Molar Volume: 199.2±5.0 cm3

Click to predict properties on the Chemicalize site


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