Found 13 results

Search term: MF = 'C_{22}H_{22}O_{5}S_{2}'
ChemSpider 2D Image | 3-(Phenylsulfonyl)propyl 4-(4-methoxyphenyl)-5-methyl-2-thiophenecarboxylate | C22H22O5S2

3-(Phenylsulfonyl)propyl 4-(4-methoxyphenyl)-5-methyl-2-thiophenecarboxylate

  • Molecular FormulaC22H22O5S2
  • Average mass430.537 Da
  • Monoisotopic mass430.090851 Da
  • ChemSpider ID115188719

More details:

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

2-Thiophenecarboxylic acid, 4-(4-methoxyphenyl)-5-methyl-, 3-(phenylsulfonyl)propyl ester [ACD/Index Name]
3-(Phenylsulfonyl)propyl 4-(4-methoxyphenyl)-5-methyl-2-thiophenecarboxylate [ACD/IUPAC Name]
3-(Phenylsulfonyl)propyl-4-(4-methoxyphenyl)-5-methyl-2-thiophencarboxylat [German] [ACD/IUPAC Name]
4-(4-Méthoxyphényl)-5-méthyl-2-thiophènecarboxylate de 3-(phénylsulfonyl)propyle [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: 611.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 323.5±31.5 °C
Index of Refraction: 1.585
Molar Refractivity: 114.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 2785.92
ACD/KOC (pH 5.5): 10174.29
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2785.92
ACD/KOC (pH 7.4): 10174.29
Polar Surface Area: 106 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 47.5±3.0 dyne/cm
Molar Volume: 341.5±3.0 cm3

Click to predict properties on the Chemicalize site


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