ChemSpider 2D Image | 4-Chloro-2-(4-chlorobutyl)-5,6-dimethylthieno[2,3-d]pyrimidine | C12H14Cl2N2S

4-Chloro-2-(4-chlorobutyl)-5,6-dimethylthieno[2,3-d]pyrimidine

  • Molecular FormulaC12H14Cl2N2S
  • Average mass289.224 Da
  • Monoisotopic mass288.025482 Da
  • ChemSpider ID24202579

More details:

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

4-Chlor-2-(4-chlorbutyl)-5,6-dimethylthieno[2,3-d]pyrimidin [German] [ACD/IUPAC Name]
4-Chloro-2-(4-chlorobutyl)-5,6-dimethylthieno[2,3-d]pyrimidine [ACD/IUPAC Name]
4-Chloro-2-(4-chlorobutyl)-5,6-diméthylthiéno[2,3-d]pyrimidine [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidine, 4-chloro-2-(4-chlorobutyl)-5,6-dimethyl- [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: 355.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 57.7±3.0 kJ/mol
Flash Point: 169.1±27.9 °C
Index of Refraction: 1.612
Molar Refractivity: 76.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 2276.26
ACD/KOC (pH 5.5): 8804.12
ACD/LogD (pH 7.4): 4.72
ACD/BCF (pH 7.4): 2276.43
ACD/KOC (pH 7.4): 8804.78
Polar Surface Area: 54 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 221.2±3.0 cm3

Click to predict properties on the Chemicalize site


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