Found 32 results

Search term: MF = 'C_{16}H_{12}O_{6}S'
ChemSpider 2D Image | 7-[(2-Hydroxyethyl)sulfinyl]-9-oxo-9H-xanthene-2-carboxylic acid | C16H12O6S

7-[(2-Hydroxyethyl)sulfinyl]-9-oxo-9H-xanthene-2-carboxylic acid

  • Molecular FormulaC16H12O6S
  • Average mass332.328 Da
  • Monoisotopic mass332.035461 Da
  • ChemSpider ID15233566

More details:

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

7-[(2-Hydroxyethyl)sulfinyl]-9-oxo-9H-xanthen-2-carbonsäure [German] [ACD/IUPAC Name]
7-[(2-Hydroxyethyl)sulfinyl]-9-oxo-9H-xanthene-2-carboxylic acid [ACD/IUPAC Name]
9H-Xanthene-2-carboxylic acid, 7-[(2-hydroxyethyl)sulfinyl]-9-oxo- [ACD/Index Name]
Acide 7-[(2-hydroxyéthyl)sulfinyl]-9-oxo-9H-xanthène-2-carboxylique [French] [ACD/IUPAC Name]
7-(2-Hydroxy-ethanesulfinyl)-9-oxo-9H-xanthene-2-carboxylic acid

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

Density: 1.7±0.1 g/cm3
Boiling Point: 682.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.2±3.0 kJ/mol
Flash Point: 366.8±31.5 °C
Index of Refraction: 1.751
Molar Refractivity: 81.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.90
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.41
ACD/LogD (pH 7.4): -1.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 120 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 102.8±5.0 dyne/cm
Molar Volume: 200.6±5.0 cm3

Click to predict properties on the Chemicalize site


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