Found 139 results

Search term: MF = 'C_{13}H_{12}O_{4}S_{2}'
ChemSpider 2D Image | 5-[4-(Ethylsulfonyl)phenyl]-2-thiophenecarboxylic acid | C13H12O4S2

5-[4-(Ethylsulfonyl)phenyl]-2-thiophenecarboxylic acid

  • Molecular FormulaC13H12O4S2
  • Average mass296.362 Da
  • Monoisotopic mass296.017700 Da
  • ChemSpider ID27730288

More details:

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

2-Thiophenecarboxylic acid, 5-[4-(ethylsulfonyl)phenyl]- [ACD/Index Name]
5-[4-(Ethylsulfonyl)phenyl]-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
5-[4-(Ethylsulfonyl)phenyl]-2-thiophenecarboxylic acid [ACD/IUPAC Name]
Acide 5-[4-(éthylsulfonyl)phényl]-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
5-[4-(ethylsulfonyl)phenyl]thiophene-2-carboxylic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 544.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 283.2±30.1 °C
Index of Refraction: 1.604
Molar Refractivity: 74.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 0.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.20
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 215.0±3.0 cm3

Click to predict properties on the Chemicalize site


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