ChemSpider 2D Image | 2,3-Bis[(3-methoxybenzoyl)oxy]-4-[(4-methoxyphenyl)amino]-4-oxobutanoic acid | C27H25NO10

2,3-Bis[(3-methoxybenzoyl)oxy]-4-[(4-methoxyphenyl)amino]-4-oxobutanoic acid

  • Molecular FormulaC27H25NO10
  • Average mass523.488 Da
  • Monoisotopic mass523.147827 Da
  • ChemSpider ID79914985

More details:

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

2,3-Bis[(3-methoxybenzoyl)oxy]-4-[(4-methoxyphenyl)amino]-4-oxobutanoic acid [ACD/IUPAC Name]
2,3-Bis[(3-methoxybenzoyl)oxy]-4-[(4-methoxyphenyl)amino]-4-oxobutansäure [German] [ACD/IUPAC Name]
Acide 2,3-bis[(3-méthoxybenzoyl)oxy]-4-[(4-méthoxyphényl)amino]-4-oxobutanoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-methoxy-, 1-carboxy-2-[[(4-methoxyphenyl)amino]carbonyl]-1,2-ethanediyl ester [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: 782.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.4±3.0 kJ/mol
Flash Point: 426.9±32.9 °C
Index of Refraction: 1.608
Molar Refractivity: 134.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 7.09
ACD/LogD (pH 5.5): 1.40
ACD/BCF (pH 5.5): 1.02
ACD/KOC (pH 5.5): 3.72
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.85
Polar Surface Area: 147 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 387.5±3.0 cm3

Click to predict properties on the Chemicalize site


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