ChemSpider 2D Image | 6-Chloro-5-[(5-chloro-3-thienyl)ethynyl]-4-pyrimidinol | C10H4Cl2N2OS

6-Chloro-5-[(5-chloro-3-thienyl)ethynyl]-4-pyrimidinol

  • Molecular FormulaC10H4Cl2N2OS
  • Average mass271.123 Da
  • Monoisotopic mass269.942139 Da
  • ChemSpider ID101855350

More details:

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

4-Pyrimidinol, 6-chloro-5-[2-(5-chloro-3-thienyl)ethynyl]- [ACD/Index Name]
6-Chlor-5-[(5-chlor-3-thienyl)ethinyl]-4-pyrimidinol [German] [ACD/IUPAC Name]
6-Chloro-5-[(5-chloro-3-thienyl)ethynyl]-4-pyrimidinol [ACD/IUPAC Name]
6-Chloro-5-[(5-chloro-3-thiényl)éthynyl]-4-pyrimidinol [French] [ACD/IUPAC 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: 450.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 226.4±28.7 °C
Index of Refraction: 1.717
Molar Refractivity: 63.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 1.22
ACD/KOC (pH 5.5): 12.00
ACD/LogD (pH 7.4): 0.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.57
Polar Surface Area: 74 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 91.8±5.0 dyne/cm
Molar Volume: 161.6±5.0 cm3

Click to predict properties on the Chemicalize site


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