Found 2 results

Search term: VJNHLBITQGJPFU (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[(2-Isopropoxyethoxy)carbonyl]-3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indolium | C24H32NO7

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

  • Molecular FormulaC24H32NO7
  • Average mass446.513 Da
  • Monoisotopic mass446.217316 Da
  • ChemSpider ID21471298

  • 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-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-, 2-(1-methylethoxy)ethyl ester, conjugate acid [ACD/Index Name]
2-[(2-Isopropoxyethoxy)carbonyl]-3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indolium [ACD/IUPAC Name]
2-[(2-Isopropoxyethoxy)carbonyl]-3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indolium [German] [ACD/IUPAC Name]
2-[(2-Isopropoxyéthoxy)carbonyl]-3-méthyl-4-oxo-6-(3,4,5-triméthoxyphényl)-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: 582.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.8±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 336.80
ACD/KOC (pH 5.5): 2242.32
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 336.80
ACD/KOC (pH 7.4): 2242.32
Polar Surface Area: 80 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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