Found 359 results

Search term: MF = 'C_{15}H_{11}FN_{2}O_{3}S'
ChemSpider 2D Image | Methyl [7-(3-fluorophenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetate | C15H11FN2O3S

Methyl [7-(3-fluorophenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetate

  • Molecular FormulaC15H11FN2O3S
  • Average mass318.323 Da
  • Monoisotopic mass318.047455 Da
  • ChemSpider ID22525145

More details:

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

[7-(3-Fluorophényl)-4-oxothiéno[3,2-d]pyrimidin-3(4H)-yl]acétate de méthyle [French] [ACD/IUPAC Name]
Methyl [7-(3-fluorophenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetate [ACD/IUPAC Name]
Methyl-[7-(3-fluorphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetat [German] [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidine-3(4H)-acetic acid, 7-(3-fluorophenyl)-4-oxo-, methyl ester [ACD/Index Name]
1105215-77-7 [RN]
methyl 2-(7-(3-fluorophenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)acetate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 476.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.0±3.0 kJ/mol
Flash Point: 242.0±31.5 °C
Index of Refraction: 1.658
Molar Refractivity: 81.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 52.82
ACD/KOC (pH 5.5): 595.35
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 52.82
ACD/KOC (pH 7.4): 595.35
Polar Surface Area: 87 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 52.1±7.0 dyne/cm
Molar Volume: 221.7±7.0 cm3

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