Found 1 result

Search term: RBNBDIMXFJYDLQ (Found by InChIKey (skeleton match))
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] [RN]
More...

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

    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


    Advertisement