Found 39 results

Search term: MF = 'C_{17}H_{15}FO_{3}S'
ChemSpider 2D Image | 2-(4-Fluorophenyl)-2-oxoethyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate | C17H15FO3S

2-(4-Fluorophenyl)-2-oxoethyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

  • Molecular FormulaC17H15FO3S
  • Average mass318.363 Da
  • Monoisotopic mass318.072601 Da
  • ChemSpider ID33000655

More details:

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

2-(4-Fluorophenyl)-2-oxoethyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate [ACD/IUPAC Name]
2-(4-Fluorphenyl)-2-oxoethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-carboxylat [German] [ACD/IUPAC Name]
4,5,6,7-Tétrahydro-1-benzothiophène-2-carboxylate de 2-(4-fluorophényl)-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzo[b]thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro-, 2-(4-fluorophenyl)-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 510.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 262.3±30.1 °C
Index of Refraction: 1.595
Molar Refractivity: 82.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1349.91
ACD/KOC (pH 5.5): 6057.20
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1349.91
ACD/KOC (pH 7.4): 6057.20
Polar Surface Area: 72 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 243.8±3.0 cm3

Click to predict properties on the Chemicalize site


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