Found 32 results

Search term: MF = 'C_{16}H_{12}O_{6}S'
ChemSpider 2D Image | 5-({[2-(1-Benzofuran-2-yl)-2-oxoethyl]sulfinyl}methyl)-2-furoic acid | C16H12O6S

5-({[2-(1-Benzofuran-2-yl)-2-oxoethyl]sulfinyl}methyl)-2-furoic acid

  • Molecular FormulaC16H12O6S
  • Average mass332.328 Da
  • Monoisotopic mass332.035461 Da
  • ChemSpider ID60307163

More details:

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

2-Furancarboxylic acid, 5-[[[2-(2-benzofuranyl)-2-oxoethyl]sulfinyl]methyl]- [ACD/Index Name]
5-({[2-(1-Benzofuran-2-yl)-2-oxoethyl]sulfinyl}methyl)-2-furoesäure [German] [ACD/IUPAC Name]
5-({[2-(1-Benzofuran-2-yl)-2-oxoethyl]sulfinyl}methyl)-2-furoic acid [ACD/IUPAC Name]
Acide 5-({[2-(1-benzofuran-2-yl)-2-oxoéthyl]sulfinyl}méthyl)-2-furoïque [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 651.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.9±3.0 kJ/mol
Flash Point: 347.7±31.5 °C
Index of Refraction: 1.686
Molar Refractivity: 83.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.58
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 76.0±3.0 dyne/cm
Molar Volume: 219.9±3.0 cm3

Click to predict properties on the Chemicalize site


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