ChemSpider 2D Image | 1-Butyl-3'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1'-[3-(dimethylamino)propyl]-4'-hydroxyspiro[indole-3,2'-pyrrole]-2,5'(1H,1'H)-dione | C29H33N3O6

1-Butyl-3'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1'-[3-(dimethylamino)propyl]-4'-hydroxyspiro[indole-3,2'-pyrrole]-2,5'(1H,1'H)-dione

  • Molecular FormulaC29H33N3O6
  • Average mass519.589 Da
  • Monoisotopic mass519.236938 Da
  • ChemSpider ID12237299

More details:

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

1-Butyl-3'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1'-[3-(dimethylamino)propyl]-4'-hydroxyspiro[indole-3,2'-pyrrole]-2,5'(1H,1'H)-dion [German] [ACD/IUPAC Name]
1-Butyl-3'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1'-[3-(dimethylamino)propyl]-4'-hydroxyspiro[indole-3,2'-pyrrole]-2,5'(1H,1'H)-dione [ACD/IUPAC Name]
1-Butyl-3'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1'-[3-(diméthylamino)propyl]-4'-hydroxyspiro[indole-3,2'-pyrrole]-2,5'(1H,1'H)-dione [French] [ACD/IUPAC Name]
Spiro[3H-indole-3,2'-[2H]pyrrole]-2,5'(1'H,1H)-dione, 1-butyl-3'-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbonyl]-1'-[3-(dimethylamino)propyl]-4'-hydroxy- [ACD/Index Name]
1-butyl-3'-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-1'-(3-(dimethylamino)propyl)-4'-hydroxyspiro[indoline-3,2'-pyrrole]-2,5'(1'H)-dione
4-(2H,3H-benzo[3,4-e]1,4-dioxan-6-ylcarbonyl)-1-[3-(dimethylamino)propyl]-6-butyl-3-hydroxyspiro[3-pyrroline-5,3'-indoline]-2,7-dione
847242-87-9 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 768.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 117.4±3.0 kJ/mol
    Flash Point: 418.6±32.9 °C
    Index of Refraction: 1.659
    Molar Refractivity: 140.5±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 5.05
    ACD/LogD (pH 5.5): 0.45
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.93
    ACD/LogD (pH 7.4): 0.49
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.18
    Polar Surface Area: 100 Å2
    Polarizability: 55.7±0.5 10-24cm3
    Surface Tension: 67.8±5.0 dyne/cm
    Molar Volume: 381.0±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement