ChemSpider 2D Image | 2-[(3,4-Dimethoxybenzoyl)oxy]-4-hydroxy-6-methoxybenzoic acid | C17H16O8

2-[(3,4-Dimethoxybenzoyl)oxy]-4-hydroxy-6-methoxybenzoic acid

  • Molecular FormulaC17H16O8
  • Average mass348.304 Da
  • Monoisotopic mass348.084503 Da
  • ChemSpider ID28712748

More details:






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

2-[(3,4-Dimethoxybenzoyl)oxy]-4-hydroxy-6-methoxybenzoesäure [German] [ACD/IUPAC Name]
2-[(3,4-Dimethoxybenzoyl)oxy]-4-hydroxy-6-methoxybenzoic acid [ACD/IUPAC Name]
Acide 2-[(3,4-diméthoxybenzoyl)oxy]-4-hydroxy-6-méthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[(3,4-dimethoxybenzoyl)oxy]-4-hydroxy-6-methoxy- [ACD/Index Name]
2-((3,4-Dimethoxybenzoyl)oxy)-4-hydroxy-6-methoxybenzoic acid
95517-99-0 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 621.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 229.1±25.0 °C
Index of Refraction: 1.593
Molar Refractivity: 86.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 0.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.95
ACD/LogD (pH 7.4): -0.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 255.8±3.0 cm3

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