ChemSpider 2D Image | 5-Iodo-N-(3-thienyl)-2-pyrimidinamine | C8H6IN3S

5-Iodo-N-(3-thienyl)-2-pyrimidinamine

  • Molecular FormulaC8H6IN3S
  • Average mass303.123 Da
  • Monoisotopic mass302.932709 Da
  • ChemSpider ID43959317

More details:

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

2-Pyrimidinamine, 5-iodo-N-3-thienyl- [ACD/Index Name]
5-Iod-N-(3-thienyl)-2-pyrimidinamin [German] [ACD/IUPAC Name]
5-Iodo-N-(3-thienyl)-2-pyrimidinamine [ACD/IUPAC Name]
5-Iodo-N-(3-thiényl)-2-pyrimidinamine [French] [ACD/IUPAC Name]
1592764-91-4 [RN]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 422.8±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 209.5±28.2 °C
Index of Refraction: 1.759
Molar Refractivity: 63.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 52.75
ACD/KOC (pH 5.5): 594.79
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 52.75
ACD/KOC (pH 7.4): 594.84
Polar Surface Area: 66 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 72.4±3.0 dyne/cm
Molar Volume: 153.5±3.0 cm3

Click to predict properties on the Chemicalize site


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