ChemSpider 2D Image | [4-({4-(4-Methoxyphenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}methoxy)-2-methylphenoxy]acetic acid | C30H31NO5S

[4-({4-(4-Methoxyphenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}methoxy)-2-methylphenoxy]acetic acid

  • Molecular FormulaC30H31NO5S
  • Average mass517.636 Da
  • Monoisotopic mass517.192322 Da
  • ChemSpider ID24660165

More details:

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

[4-({4-(4-Methoxyphenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}methoxy)-2-methylphenoxy]acetic acid [ACD/IUPAC Name]
[4-({4-(4-Methoxyphenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}methoxy)-2-methylphenoxy]essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[4-[[5-[4-(1,1-dimethylethyl)phenyl]-4-(4-methoxyphenyl)-2-thiazolyl]methoxy]-2-methylphenoxy]- [ACD/Index Name]
Acide [4-({4-(4-méthoxyphényl)-5-[4-(2-méthyl-2-propanyl)phényl]-1,3-thiazol-2-yl}méthoxy)-2-méthylphénoxy]acétique [French] [ACD/IUPAC 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: 654.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.3±3.0 kJ/mol
Flash Point: 349.8±31.5 °C
Index of Refraction: 1.595
Molar Refractivity: 145.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.91
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 189.08
ACD/KOC (pH 5.5): 339.71
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 8.33
ACD/KOC (pH 7.4): 14.96
Polar Surface Area: 106 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 429.5±3.0 cm3

Click to predict properties on the Chemicalize site


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