ChemSpider 2D Image | 4-Chloro-2-ethyl-6-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]pyrimidine | C8H9ClN6S

4-Chloro-2-ethyl-6-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]pyrimidine

  • Molecular FormulaC8H9ClN6S
  • Average mass256.715 Da
  • Monoisotopic mass256.029785 Da
  • ChemSpider ID36591746

More details:

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

4-Chlor-2-ethyl-6-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]pyrimidin [German] [ACD/IUPAC Name]
4-Chloro-2-ethyl-6-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]pyrimidine [ACD/IUPAC Name]
4-Chloro-2-éthyl-6-[(1-méthyl-1H-tétrazol-5-yl)sulfanyl]pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 4-chloro-2-ethyl-6-[(1-methyl-1H-tetrazol-5-yl)thio]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 434.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 216.4±31.5 °C
Index of Refraction: 1.751
Molar Refractivity: 65.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.91
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 5.63
ACD/KOC (pH 5.5): 119.90
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 5.63
ACD/KOC (pH 7.4): 119.90
Polar Surface Area: 95 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 61.2±7.0 dyne/cm
Molar Volume: 160.8±7.0 cm3

Click to predict properties on the Chemicalize site


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