ChemSpider 2D Image | Methyl 2-(2,4-diisopropoxyphenyl)-8-isopropoxy-1-(3-isopropoxyphenyl)-9-methoxypyrrolo[2,1-a]isoquinoline-3-carboxylate | C39H45NO7

Methyl 2-(2,4-diisopropoxyphenyl)-8-isopropoxy-1-(3-isopropoxyphenyl)-9-methoxypyrrolo[2,1-a]isoquinoline-3-carboxylate

  • Molecular FormulaC39H45NO7
  • Average mass639.777 Da
  • Monoisotopic mass639.319580 Da
  • ChemSpider ID9832215

More details:

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

2-(2,4-Diisopropoxyphényl)-8-isopropoxy-1-(3-isopropoxyphényl)-9-méthoxypyrrolo[2,1-a]isoquinoléine-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-(2,4-diisopropoxyphenyl)-8-isopropoxy-1-(3-isopropoxyphenyl)-9-methoxypyrrolo[2,1-a]isoquinoline-3-carboxylate [ACD/IUPAC Name]
Methyl-2-(2,4-diisopropoxyphenyl)-8-isopropoxy-1-(3-isopropoxyphenyl)-9-methoxypyrrolo[2,1-a]isochinolin-3-carboxylat [German] [ACD/IUPAC Name]
Pyrrolo[2,1-a]isoquinoline-3-carboxylic acid, 2-[2,4-bis(1-methylethoxy)phenyl]-9-methoxy-8-(1-methylethoxy)-1-[3-(1-methylethoxy)phenyl]-, methyl ester [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.565
Molar Refractivity: 180.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 9.06
ACD/LogD (pH 5.5): 8.25
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 733570.38
ACD/LogD (pH 7.4): 8.25
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 733570.38
Polar Surface Area: 77 Å2
Polarizability: 71.7±0.5 10-24cm3
Surface Tension: 36.7±7.0 dyne/cm
Molar Volume: 554.8±7.0 cm3

Click to predict properties on the Chemicalize site


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