ChemSpider 2D Image | 2-Phenoxyethyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate | C27H27Cl2NO4

2-Phenoxyethyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

  • Molecular FormulaC27H27Cl2NO4
  • Average mass500.414 Da
  • Monoisotopic mass499.131714 Da
  • ChemSpider ID2376101

More details:

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

2-Phenoxyethyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate [ACD/IUPAC Name]
2-Phenoxyethyl-4-(2,3-dichlorphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-chinolincarboxylat [German] [ACD/IUPAC Name]
3-Quinolinecarboxylic acid, 4-(2,3-dichlorophenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, 2-phenoxyethyl ester [ACD/Index Name]
4-(2,3-Dichlorophényl)-2,7,7-triméthyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinoléinecarboxylate de 2-phénoxyéthyle [French] [ACD/IUPAC Name]
2-phenoxyethyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-phenoxyethyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,7,8-pentahydroquinoline-3-carboxylate
2-phenoxyethyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
313244-55-2 [RN]
4-(2,3-Dichloro-phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid 2-phenoxy-ethyl ester
AC1MK1MB
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AG-690/12889799 [DBID]
BAS 00915302 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 626.3±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 92.7±3.0 kJ/mol
    Flash Point: 332.6±31.5 °C
    Index of Refraction: 1.618
    Molar Refractivity: 132.8±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 5.66
    ACD/LogD (pH 5.5): 6.08
    ACD/BCF (pH 5.5): 24419.37
    ACD/KOC (pH 5.5): 48119.66
    ACD/LogD (pH 7.4): 6.08
    ACD/BCF (pH 7.4): 24419.98
    ACD/KOC (pH 7.4): 48120.87
    Polar Surface Area: 65 Å2
    Polarizability: 52.6±0.5 10-24cm3
    Surface Tension: 54.1±5.0 dyne/cm
    Molar Volume: 378.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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