ChemSpider 2D Image | (5-{3-[4-(4-Biphenylylcarbonyl)-2-propylphenoxy]propoxy}-1H-indol-1-yl)acetic acid | C35H33NO5

(5-{3-[4-(4-Biphenylylcarbonyl)-2-propylphenoxy]propoxy}-1H-indol-1-yl)acetic acid

  • Molecular FormulaC35H33NO5
  • Average mass547.640 Da
  • Monoisotopic mass547.235901 Da
  • ChemSpider ID26325863

More details:

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

(5-{3-[4-(4-Biphenylylcarbonyl)-2-propylphenoxy]propoxy}-1H-indol-1-yl)acetic acid [ACD/IUPAC Name]
(5-{3-[4-(4-Biphenylylcarbonyl)-2-propylphenoxy]propoxy}-1H-indol-1-yl)essigsäure [German] [ACD/IUPAC Name]
(5-{3-[4-(Biphenyl-4-Ylcarbonyl)-2-Propylphenoxy]propoxy}-1h-Indol-1-Yl)acetic Acid
1H-Indole-1-acetic acid, 5-[3-[4-([1,1'-biphenyl]-4-ylcarbonyl)-2-propylphenoxy]propoxy]- [ACD/Index Name]
Acide (5-{3-[4-(4-biphénylylcarbonyl)-2-propylphénoxy]propoxy}-1H-indol-1-yl)acétique [French] [ACD/IUPAC Name]
5BC

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

Density: 1.2±0.1 g/cm3
Boiling Point: 765.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.9±3.0 kJ/mol
Flash Point: 416.4±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 160.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 8.23
ACD/LogD (pH 5.5): 5.88
ACD/BCF (pH 5.5): 8369.59
ACD/KOC (pH 5.5): 9492.17
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 140.65
ACD/KOC (pH 7.4): 159.51
Polar Surface Area: 78 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 45.5±7.0 dyne/cm
Molar Volume: 467.3±7.0 cm3

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