ChemSpider 2D Image | 2-[3-(5-Pyrimidinyl)phenyl]naphtho[2,1-d][1,3]thiazole | C21H13N3S

2-[3-(5-Pyrimidinyl)phenyl]naphtho[2,1-d][1,3]thiazole

  • Molecular FormulaC21H13N3S
  • Average mass339.413 Da
  • Monoisotopic mass339.083008 Da
  • ChemSpider ID102117208

More details:

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

2-[3-(5-Pyrimidinyl)phenyl]naphtho[2,1-d][1,3]thiazol [German] [ACD/IUPAC Name]
2-[3-(5-Pyrimidinyl)phenyl]naphtho[2,1-d][1,3]thiazole [ACD/IUPAC Name]
2-[3-(5-Pyrimidinyl)phényl]naphto[2,1-d][1,3]thiazole [French] [ACD/IUPAC Name]
Naphtho[2,1-d]thiazole, 2-[3-(5-pyrimidinyl)phenyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 599.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 300.1±23.3 °C
Index of Refraction: 1.740
Molar Refractivity: 103.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 4.66
ACD/BCF (pH 5.5): 2059.37
ACD/KOC (pH 5.5): 8195.00
ACD/LogD (pH 7.4): 4.66
ACD/BCF (pH 7.4): 2059.68
ACD/KOC (pH 7.4): 8196.23
Polar Surface Area: 67 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 257.4±3.0 cm3

Click to predict properties on the Chemicalize site


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