Found 215 results

Search term: MF = 'C_{17}H_{16}N_{2}S_{2}'
ChemSpider 2D Image | 2-(2-Methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-4(1H)-thione | C17H16N2S2

2-(2-Methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-4(1H)-thione

  • Molecular FormulaC17H16N2S2
  • Average mass312.452 Da
  • Monoisotopic mass312.075500 Da
  • ChemSpider ID17824851

More details:

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

[1]Benzothieno[2,3-d]pyrimidine-4-thiol, 5,6,7,8-tetrahydro-2-(2-methylphenyl)- [ACD/Index Name]
2-(2-Methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-thion [German] [ACD/IUPAC Name]
2-(2-Methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-4(1H)-thione [ACD/IUPAC Name]
2-(2-Méthylphényl)-5,6,7,8-tétrahydro[1]benzothiéno[2,3-d]pyrimidine-4(1H)-thione [French] [ACD/IUPAC Name]
2-o-Tolyl-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidine-4-thiol
917749-80-5 [RN]
MFCD08898831

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

Density: 1.3±0.1 g/cm3
Boiling Point: 424.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.3±3.0 kJ/mol
Flash Point: 210.6±26.5 °C
Index of Refraction: 1.701
Molar Refractivity: 93.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 42.90
ACD/KOC (pH 5.5): 103.53
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 15.10
ACD/KOC (pH 7.4): 36.42
Polar Surface Area: 93 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 240.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement