ChemSpider 2D Image | Dimethyl 3-[4,5-dimethoxy-2-(methoxymethoxy)phenyl]-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2,5-dicarboxylate | C26H29NO10

Dimethyl 3-[4,5-dimethoxy-2-(methoxymethoxy)phenyl]-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2,5-dicarboxylate

  • Molecular FormulaC26H29NO10
  • Average mass515.509 Da
  • Monoisotopic mass515.179138 Da
  • ChemSpider ID8340225

More details:






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

1H-Pyrrole-2,5-dicarboxylic acid, 3-[4,5-dimethoxy-2-(methoxymethoxy)phenyl]-4-(3,4-dimethoxyphenyl)-, dimethyl ester [ACD/Index Name]
3-[4,5-Diméthoxy-2-(méthoxyméthoxy)phényl]-4-(3,4-diméthoxyphényl)-1H-pyrrole-2,5-dicarboxylate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 3-[4,5-dimethoxy-2-(methoxymethoxy)phenyl]-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2,5-dicarboxylate [ACD/IUPAC Name]
Dimethyl-3-[4,5-dimethoxy-2-(methoxymethoxy)phenyl]-4-(3,4-dimethoxyphenyl)-1H-pyrrol-2,5-dicarboxylat [German] [ACD/IUPAC Name]
2,5-dimethyl 3-[4,5-dimethoxy-2-(methoxymethoxy)phenyl]-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2,5-dicarboxylate
266674-74-2 [RN]
3-(4,5-Dimethoxy-2-methoxymethoxy-phenyl)-4-(3,4-dimethoxy-phenyl)-1H-pyrrole-2,5-dicarboxylic acid dimethyl ester

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

Density: 1.2±0.1 g/cm3
Boiling Point: 642.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.6±31.5 °C
Index of Refraction: 1.552
Molar Refractivity: 133.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 2.87
ACD/BCF (pH 5.5): 89.09
ACD/KOC (pH 5.5): 865.54
ACD/LogD (pH 7.4): 2.87
ACD/BCF (pH 7.4): 89.08
ACD/KOC (pH 7.4): 865.52
Polar Surface Area: 124 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 417.0±3.0 cm3

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