ChemSpider 2D Image | (2-{[4-(Benzyloxy)-3-methoxybenzyl]oxy}-5-bromo-3-methoxyphenyl)acetic acid | C24H23BrO6

(2-{[4-(Benzyloxy)-3-methoxybenzyl]oxy}-5-bromo-3-methoxyphenyl)acetic acid

  • Molecular FormulaC24H23BrO6
  • Average mass487.340 Da
  • Monoisotopic mass486.067780 Da
  • ChemSpider ID24776192

More details:

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

(2-{[4-(Benzyloxy)-3-methoxybenzyl]oxy}-5-brom-3-methoxyphenyl)essigsäure [German] [ACD/IUPAC Name]
(2-{[4-(Benzyloxy)-3-methoxybenzyl]oxy}-5-bromo-3-methoxyphenyl)acetic acid [ACD/IUPAC Name]
2-{2-[4-(Benzyloxy)-3-methoxybenzyloxy]-5-bromo-3-methoxyphenyl}acetic acid
Acide (2-{[4-(benzyloxy)-3-méthoxybenzyl]oxy}-5-bromo-3-méthoxyphényl)acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 5-bromo-3-methoxy-2-[[3-methoxy-4-(phenylmethoxy)phenyl]methoxy]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 607.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 321.0±30.1 °C
Index of Refraction: 1.605
Molar Refractivity: 120.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 3.31
ACD/BCF (pH 5.5): 77.23
ACD/KOC (pH 5.5): 264.12
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 1.61
ACD/KOC (pH 7.4): 5.51
Polar Surface Area: 74 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 350.5±3.0 cm3

Click to predict properties on the Chemicalize site


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