ChemSpider 2D Image | 2'-Isobutyl-4'-(4-morpholinylcarbonyl)-2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-one | C23H32N2O3

2'-Isobutyl-4'-(4-morpholinylcarbonyl)-2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-one

  • Molecular FormulaC23H32N2O3
  • Average mass384.512 Da
  • Monoisotopic mass384.241302 Da
  • ChemSpider ID31014339

More details:

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

2'-Isobutyl-4'-(4-morpholinylcarbonyl)-2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-on [German] [ACD/IUPAC Name]
2'-Isobutyl-4'-(4-morpholinylcarbonyl)-2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-one [ACD/IUPAC Name]
2'-Isobutyl-4'-(4-morpholinylcarbonyl)-2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-one [French] [ACD/IUPAC Name]
Spiro[cyclohexane-1,3'(2'H)-isoquinolin]-1'(4'H)-one, 2'-(2-methylpropyl)-4'-(4-morpholinylcarbonyl)- [ACD/Index Name]
1323954-79-5 [RN]
2'-(2-methylpropyl)-4'-(morpholin-4-ylcarbonyl)-2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-one
2-(2-methylpropyl)-4-(morpholine-4-carbonyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-1-one

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 577.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 86.5±3.0 kJ/mol
    Flash Point: 303.1±30.1 °C
    Index of Refraction: 1.585
    Molar Refractivity: 109.0±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.21
    ACD/LogD (pH 5.5): 3.66
    ACD/BCF (pH 5.5): 353.87
    ACD/KOC (pH 5.5): 2323.11
    ACD/LogD (pH 7.4): 3.66
    ACD/BCF (pH 7.4): 353.87
    ACD/KOC (pH 7.4): 2323.11
    Polar Surface Area: 50 Å2
    Polarizability: 43.2±0.5 10-24cm3
    Surface Tension: 51.1±5.0 dyne/cm
    Molar Volume: 325.4±5.0 cm3

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