ChemSpider 2D Image | 1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxylatomethoxy)-4-methoxyphenyl]-5-propoxy-2-indanecarboxylate | C29H26O9

1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxylatomethoxy)-4-methoxyphenyl]-5-propoxy-2-indanecarboxylate

  • Molecular FormulaC29H26O9
  • Average mass518.512 Da
  • Monoisotopic mass518.158752 Da
  • ChemSpider ID95640950

  • Charge - Charge

More details:

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

1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxylatomethoxy)-4-methoxyphenyl]-5-propoxy-2-indancarboxylat [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxylatomethoxy)-4-methoxyphenyl]-5-propoxy-2-indanecarboxylate [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxylatométhoxy)-4-méthoxyphényl]-5-propoxy-2-indanecarboxylate [French] [ACD/IUPAC Name]
1H-Indene-2-carboxylic acid, 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethoxy)-4-methoxyphenyl]-2,3-dihydro-5-propoxy-, ion(2-) [ACD/Index Name]

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

Density:
Boiling Point: 704.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.3±3.0 kJ/mol
Flash Point: 233.3±26.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.16
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.43
ACD/LogD (pH 7.4): -0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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