ChemSpider 2D Image | 2-{2-[(2-{2-[(2-{2-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoic acid | C38H38O16

2-{2-[(2-{2-[(2-{2-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoic acid

  • Molecular FormulaC38H38O16
  • Average mass750.699 Da
  • Monoisotopic mass750.216003 Da
  • ChemSpider ID7986463

More details:

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

2-{2-[(2-{2-[(2-{2-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoesäure [German] [ACD/IUPAC Name]
2-{2-[(2-{2-[(2-{2-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoic acid [ACD/IUPAC Name]
Acide 2-{2-[(2-{2-[(2-{2-[(2,4-dihydroxy-6-méthylbenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoyl)oxy]propyl}-4,6-dihydroxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[2-[(2,4-dihydroxy-6-methylbenzoyl)oxy]propyl]-4,6-dihydroxy-, 2-[2-[[2-(2-carboxy-3,5-dihydroxyphenyl)-1-methylethoxy]carbonyl]-3,5-dihydroxyphenyl]-1-methylethyl ester [ACD/Index Name]
FR191512

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

Density: 1.5±0.1 g/cm3
Boiling Point: 1042.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 159.8±3.0 kJ/mol
Flash Point: 322.2±27.8 °C
Index of Refraction: 1.680
Molar Refractivity: 189.5±0.3 cm3
#H bond acceptors: 16
#H bond donors: 9
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 4
ACD/LogP: 8.27
ACD/LogD (pH 5.5): 5.78
ACD/BCF (pH 5.5): 4434.25
ACD/KOC (pH 5.5): 3488.45
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 227.88
ACD/KOC (pH 7.4): 179.28
Polar Surface Area: 278 Å2
Polarizability: 75.1±0.5 10-24cm3
Surface Tension: 77.6±3.0 dyne/cm
Molar Volume: 501.6±3.0 cm3

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