ChemSpider 2D Image | 5-Bromo-2-(3,5-dichloro-2-pyridinyl)-6-methyl-4-pyrimidinethiol | C10H6BrCl2N3S

5-Bromo-2-(3,5-dichloro-2-pyridinyl)-6-methyl-4-pyrimidinethiol

  • Molecular FormulaC10H6BrCl2N3S
  • Average mass351.050 Da
  • Monoisotopic mass348.884277 Da
  • ChemSpider ID47912731

More details:






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

4-Pyrimidinethiol, 5-bromo-2-(3,5-dichloro-2-pyridinyl)-6-methyl- [ACD/Index Name]
5-Brom-2-(3,5-dichlor-2-pyridinyl)-6-methyl-4-pyrimidinthiol [German] [ACD/IUPAC Name]
5-Bromo-2-(3,5-dichloro-2-pyridinyl)-6-methyl-4-pyrimidinethiol [ACD/IUPAC Name]
5-Bromo-2-(3,5-dichloro-2-pyridinyl)-6-méthyl-4-pyrimidinethiol [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 345.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.6±3.0 kJ/mol
Flash Point: 162.8±27.9 °C
Index of Refraction: 1.666
Molar Refractivity: 75.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 1.97
ACD/KOC (pH 5.5): 8.65
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 1.05
ACD/KOC (pH 7.4): 4.62
Polar Surface Area: 77 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 62.4±3.0 dyne/cm
Molar Volume: 203.4±3.0 cm3

Click to predict properties on the Chemicalize site






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