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Search term: YYFCDZBIVJUBDR-XNTDXEJSSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-{7-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-1H-indol-3-yl}-4,5-dihydroxy-1,2-benzoquinone | C24H25NO4

3-{7-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-1H-indol-3-yl}-4,5-dihydroxy-1,2-benzoquinone

  • Molecular FormulaC24H25NO4
  • Average mass391.460 Da
  • Monoisotopic mass391.178345 Da
  • ChemSpider ID23176452

  • Double-bond stereo - Double-bond stereo

More details:

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

3,5-Cyclohexadiene-1,2-dione, 3-[7-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-1H-indol-3-yl]-4,5-dihydroxy- [ACD/Index Name]
3-{7-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-1H-indol-3-yl}-4,5-dihydroxy-1,2-benzochinon [German] [ACD/IUPAC Name]
3-{7-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-1H-indol-3-yl}-4,5-dihydroxy-1,2-benzoquinone [ACD/IUPAC Name]
3-{7-[(2E)-3,7-Diméthyl-2,6-octadién-1-yl]-1H-indol-3-yl}-4,5-dihydroxy-1,2-benzoquinone [French] [ACD/IUPAC Name]
3-{7-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-1H-indol-3-yl}-4,5-dihydroxycyclohexa-3,5-diene-1,2-dione
3-[7-(3,7-Dimethyl-octa-2,6-dienyl)-1H-indol-3-yl]-2,5-dihydroxy-[1,4]benzoquinone

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

Density: 1.3±0.1 g/cm3
Boiling Point: 564.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 295.2±30.1 °C
Index of Refraction: 1.674
Molar Refractivity: 113.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.94
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 75.39
ACD/KOC (pH 5.5): 328.90
ACD/LogD (pH 7.4): 1.46
ACD/BCF (pH 7.4): 1.43
ACD/KOC (pH 7.4): 6.25
Polar Surface Area: 90 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 302.3±3.0 cm3

Click to predict properties on the Chemicalize site


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