ChemSpider 2D Image | thienopyrimidine | C6H4N2S

thienopyrimidine

  • Molecular FormulaC6H4N2S
  • Average mass136.174 Da
  • Monoisotopic mass136.009521 Da
  • ChemSpider ID11544120

More details:






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

272-68-4 [RN]
7-Thieno[3,2-d]pyrimidine
MFCD11110439 [MDL number]
Thieno[3,2-d]pyrimidin [German] [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidine [ACD/Index Name] [ACD/IUPAC Name]
Thiéno[3,2-d]pyrimidine [French] [ACD/IUPAC Name]
thienopyrimidine
"THIENO[3,2-D]PYRIMIDINE"
"THIENO[3,2-D]PYRIMIDINE"|"THIENO[3,2-D]PYRIMIDINE"
[272-68-4]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 246.0±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.4±3.0 kJ/mol
Flash Point: 107.4±10.2 °C
Index of Refraction: 1.705
Molar Refractivity: 38.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 7.72
ACD/KOC (pH 5.5): 150.28
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 7.72
ACD/KOC (pH 7.4): 150.30
Polar Surface Area: 54 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 65.1±3.0 dyne/cm
Molar Volume: 99.5±3.0 cm3

Click to predict properties on the Chemicalize site






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