ChemSpider 2D Image | 2'-Cyclohexyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxylic acid | C20H25NO3

2'-Cyclohexyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxylic acid

  • Molecular FormulaC20H25NO3
  • Average mass327.417 Da
  • Monoisotopic mass327.183441 Da
  • ChemSpider ID24805257

More details:

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

2'-Cyclohexyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carbonsäure [German] [ACD/IUPAC Name]
2'-Cyclohexyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxylic acid [ACD/IUPAC Name]
Acide 2'-cyclohexyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxylique [French] [ACD/IUPAC Name]
Spiro[cyclopentane-1,3'(2'H)-isoquinoline]-4'-carboxylic acid, 2'-cyclohexyl-1',4'-dihydro-1'-oxo- [ACD/Index Name]
1239843-15-2 [RN]
2-cyclohexyl-1-oxo-1,4-dihydro-2h-spiro[cyclopentane-1,3-isoquinoline]-4-carboxylic acid
2-cyclohexyl-1-oxo-2,4-dihydro-1h-spiro[cyclopentane-1,3-isoquinoline]-4-carboxylic acid
2'-cyclohexyl-1'-oxo-2',4'-dihydro-1'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxylic acid
2-cyclohexyl-1-oxospiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxylic acid
2-cyclohexyl-1-oxo-spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxylic acid
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 535.5±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 85.5±3.0 kJ/mol
    Flash Point: 277.7±30.1 °C
    Index of Refraction: 1.612
    Molar Refractivity: 91.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.18
    ACD/LogD (pH 5.5): 1.91
    ACD/BCF (pH 5.5): 7.24
    ACD/KOC (pH 5.5): 53.25
    ACD/LogD (pH 7.4): 0.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 58 Å2
    Polarizability: 36.1±0.5 10-24cm3
    Surface Tension: 57.3±5.0 dyne/cm
    Molar Volume: 261.8±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement