ChemSpider 2D Image | 2-Hexyl 3-methyl 4-(3,4-dimethoxyphenyl)-5,6,7-trimethoxy-1-(methoxymethoxy)-2,3-naphthalenedicarboxylate | C32H40O11

2-Hexyl 3-methyl 4-(3,4-dimethoxyphenyl)-5,6,7-trimethoxy-1-(methoxymethoxy)-2,3-naphthalenedicarboxylate

  • Molecular FormulaC32H40O11
  • Average mass600.653 Da
  • Monoisotopic mass600.257080 Da
  • ChemSpider ID8826578

More details:

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

2,3-Naphthalenedicarboxylic acid, 4-(3,4-dimethoxyphenyl)-5,6,7-trimethoxy-1-(methoxymethoxy)-, 2-hexyl 3-methyl ester [ACD/Index Name]
2-Hexyl 3-methyl 4-(3,4-dimethoxyphenyl)-5,6,7-trimethoxy-1-(methoxymethoxy)-2,3-naphthalenedicarboxylate [ACD/IUPAC Name]
2-Hexyl-3-methyl-4-(3,4-dimethoxyphenyl)-5,6,7-trimethoxy-1-(methoxymethoxy)-2,3-naphthalindicarboxylat [German] [ACD/IUPAC Name]
4-(3,4-Diméthoxyphényl)-5,6,7-triméthoxy-1-(méthoxyméthoxy)-2,3-naphtalènedicarboxylate de 2-hexyle et de 3-méthyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 675.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 279.1±31.5 °C
Index of Refraction: 1.542
Molar Refractivity: 161.8±0.3 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 5.15
ACD/BCF (pH 5.5): 4849.72
ACD/KOC (pH 5.5): 15129.64
ACD/LogD (pH 7.4): 5.15
ACD/BCF (pH 7.4): 4849.72
ACD/KOC (pH 7.4): 15129.64
Polar Surface Area: 117 Å2
Polarizability: 64.2±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 514.0±3.0 cm3

Click to predict properties on the Chemicalize site


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