Found 253 results

Search term: MF = 'C_{19}H_{18}O_{3}S'
ChemSpider 2D Image | Ethyl 2-oxo-6-phenyl-4-(3-thienyl)-3-cyclohexene-1-carboxylate | C19H18O3S

Ethyl 2-oxo-6-phenyl-4-(3-thienyl)-3-cyclohexene-1-carboxylate

  • Molecular FormulaC19H18O3S
  • Average mass326.409 Da
  • Monoisotopic mass326.097656 Da
  • ChemSpider ID31083292

More details:

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

2-Oxo-6-phényl-4-(3-thiényl)-3-cyclohexène-1-carboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Cyclohexene-1-carboxylic acid, 2-oxo-6-phenyl-4-(3-thienyl)-, ethyl ester [ACD/Index Name]
Ethyl 2-oxo-6-phenyl-4-(3-thienyl)-3-cyclohexene-1-carboxylate [ACD/IUPAC Name]
Ethyl-2-oxo-6-phenyl-4-(3-thienyl)-3-cyclohexen-1-carboxylat [German] [ACD/IUPAC Name]
1205545-66-9 [RN]
ethyl 2-oxo-6-phenyl-4-(thiophen-3-yl)cyclohex-3-ene-1-carboxylate
ethyl 3-oxo-5-(thiophen-3-yl)-1,2,3,6-tetrahydro-[1,1'-biphenyl]-2-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 452.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.2±3.0 kJ/mol
Flash Point: 227.7±28.7 °C
Index of Refraction: 1.593
Molar Refractivity: 90.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.45
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 1098.81
ACD/KOC (pH 5.5): 5227.42
ACD/LogD (pH 7.4): 4.30
ACD/BCF (pH 7.4): 1096.91
ACD/KOC (pH 7.4): 5218.40
Polar Surface Area: 72 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 266.2±3.0 cm3

Click to predict properties on the Chemicalize site


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