ChemSpider 2D Image | 2-(3-Methoxyphenyl)-4-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}methyl)-1,3-thiazole | C22H25NO3S2

2-(3-Methoxyphenyl)-4-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}methyl)-1,3-thiazole

  • Molecular FormulaC22H25NO3S2
  • Average mass415.569 Da
  • Monoisotopic mass415.127594 Da
  • ChemSpider ID31704418

More details:

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

2-(3-Methoxyphenyl)-4-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}methyl)-1,3-thiazol [German] [ACD/IUPAC Name]
2-(3-Methoxyphenyl)-4-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}methyl)-1,3-thiazole [ACD/IUPAC Name]
2-(3-Méthoxyphényl)-4-({[2-méthyl-5-(2-méthyl-2-propanyl)phényl]sulfonyl}méthyl)-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 4-[[[5-(1,1-dimethylethyl)-2-methylphenyl]sulfonyl]methyl]-2-(3-methoxyphenyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 611.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 323.6±34.3 °C
Index of Refraction: 1.578
Molar Refractivity: 115.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 4.99
ACD/BCF (pH 5.5): 3643.51
ACD/KOC (pH 5.5): 12329.06
ACD/LogD (pH 7.4): 4.99
ACD/BCF (pH 7.4): 3643.51
ACD/KOC (pH 7.4): 12329.07
Polar Surface Area: 93 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 346.9±3.0 cm3

Click to predict properties on the Chemicalize site


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