Found 177 results

Search term: MF = 'C_{13}H_{14}O_{3}S_{2}'
ChemSpider 2D Image | (5-Methyl-2-thienyl)methyl 4-methylbenzenesulfonate | C13H14O3S2

(5-Methyl-2-thienyl)methyl 4-methylbenzenesulfonate

  • Molecular FormulaC13H14O3S2
  • Average mass282.379 Da
  • Monoisotopic mass282.038422 Da
  • ChemSpider ID115018901

More details:

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

(5-Methyl-2-thienyl)methyl 4-methylbenzenesulfonate [ACD/IUPAC Name]
(5-Methyl-2-thienyl)methyl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
2-Thiophenemethanol, 5-methyl-, 4-methylbenzenesulfonate [ACD/Index Name]
4-Méthylbenzènesulfonate de (5-méthyl-2-thiényl)méthyle [French] [ACD/IUPAC 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: 426.6±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 211.8±25.4 °C
Index of Refraction: 1.587
Molar Refractivity: 74.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 211.31
ACD/KOC (pH 5.5): 1606.13
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 211.31
ACD/KOC (pH 7.4): 1606.13
Polar Surface Area: 80 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 220.3±3.0 cm3

Click to predict properties on the Chemicalize site


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