ChemSpider 2D Image | 2-[(2-Isopropoxyethoxy)carbonyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indolium | C17H26NO4

2-[(2-Isopropoxyethoxy)carbonyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indolium

  • Molecular FormulaC17H26NO4
  • Average mass308.392 Da
  • Monoisotopic mass308.185638 Da
  • ChemSpider ID21470928

  • Charge - Charge

More details:

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

1H-Indole-2-carboxylic acid, 4,5,6,7-tetrahydro-3,6,6-trimethyl-4-oxo-, 2-(1-methylethoxy)ethyl ester, conjugate acid [ACD/Index Name]
2-[(2-Isopropoxyethoxy)carbonyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indolium [ACD/IUPAC Name]
2-[(2-Isopropoxyethoxy)carbonyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indolium [German] [ACD/IUPAC Name]
2-[(2-Isopropoxyéthoxy)carbonyl]-3,6,6-triméthyl-4-oxo-4,5,6,7-tétrahydro-1H-indolium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 449.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 225.5±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 3.64
ACD/BCF (pH 5.5): 342.05
ACD/KOC (pH 5.5): 2267.30
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 342.05
ACD/KOC (pH 7.4): 2267.30
Polar Surface Area: 53 Å2
Polarizability:
Surface Tension:
Molar Volume:

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