ChemSpider 2D Image | 3-(2-Carboethoxybenzoyl)thiophene | C14H12O3S

3-(2-Carboethoxybenzoyl)thiophene

  • Molecular FormulaC14H12O3S
  • Average mass260.308 Da
  • Monoisotopic mass260.050720 Da
  • ChemSpider ID21398085

More details:

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

2-(3-Thiénylcarbonyl)benzoate d'éthyle [French] [ACD/IUPAC Name]
3-(2-Carboethoxybenzoyl)thiophene
904633-30-3 [RN]
Benzoic acid, 2-(3-thienylcarbonyl)-, ethyl ester [ACD/Index Name]
Ethyl 2-(3-thienylcarbonyl)benzoate [ACD/IUPAC Name]
Ethyl-2-(3-thienylcarbonyl)benzoat [German] [ACD/IUPAC Name]
[904633-30-3] [RN]
ethyl 2-(thiophene-3-carbonyl)benzoate
MFCD07699015 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 371.5±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.9±3.0 kJ/mol
Flash Point: 178.5±20.9 °C
Index of Refraction: 1.585
Molar Refractivity: 70.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 217.86
ACD/KOC (pH 5.5): 1641.65
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 217.86
ACD/KOC (pH 7.4): 1641.65
Polar Surface Area: 72 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 211.4±3.0 cm3

Click to predict properties on the Chemicalize site


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