ChemSpider 2D Image | 3,3'-Bis[(4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-1,1'-bicyclopenta[b]indole-2,2'(4H,4'H)-dione | C36H20N2O4

3,3'-Bis[(4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-1,1'-bicyclopenta[b]indole-2,2'(4H,4'H)-dione

  • Molecular FormulaC36H20N2O4
  • Average mass544.555 Da
  • Monoisotopic mass544.142334 Da
  • ChemSpider ID4589045

More details:

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

[1,1'-Bicyclopent[b]indole]-2,2'(4H,4'H)-dione, 3,3'-bis[(4-oxo-2,5-cyclohexadien-1-ylidene)methyl]- [ACD/Index Name]
3,3'-Bis[(4-oxo-2,5-cyclohexadien-1-yliden)methyl]-1,1'-bicyclopenta[b]indol-2,2'(4H,4'H)-dion [German] [ACD/IUPAC Name]
3,3'-Bis[(4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-1,1'-bicyclopenta[b]indole-2,2'(4H,4'H)-dione [ACD/IUPAC Name]
3,3'-Bis[(4-oxo-2,5-cyclohexadién-1-ylidène)méthyl]-1,1'-bicyclopenta[b]indole-2,2'(4H,4'H)-dione [French] [ACD/IUPAC Name]
(1,1'-Bicyclopent(b)indole)-2,2'(3H,3'H)-dione, 3,3'-bis((4-hydroxyphenyl)methylene)-
(1,1'-Bicyclopent(b)indole)-2,2'(3H,3'H)-dione, 3,3'-bis((4hydroxyphenyl)methylene)-3,3'-Bis((4-hydroxyphenyl)methylene)-(1,1'-bicyclopent(b)indole)-2,2'(3H,3'H)-dione
[1,1'-Bicyclopent[b]indole]-2,2'(3H,3'H)-dione,3,3'-bis[(4-hydroxyphenyl)methylene]-
1-{2-OXO-3-[(4-OXOCYCLOHEXA-2,5-DIEN-1-YLIDENE)METHYL]-2H,4H-CYCLOPENTA[B]INDOL-1-YL}-3-[(4-OXOCYCLOHEXA-2,5-DIEN-1-YLIDENE)METHYL]-2H,4H-CYCLOPENTA[B]INDOL-2-ONE
3,3'-Bis((4-hydroxyphenyl)methylene)-(1,1'-bicyclopent(b)indole)-2,2'(3H,3'H)-dione
K00271

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

nchembio825-comp2 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 759.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.7±3.0 kJ/mol
Flash Point: 216.2±33.0 °C
Index of Refraction: 1.808
Molar Refractivity: 154.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 214.12
ACD/KOC (pH 5.5): 1621.40
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 214.12
ACD/KOC (pH 7.4): 1621.40
Polar Surface Area: 92 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 79.7±5.0 dyne/cm
Molar Volume: 359.7±5.0 cm3

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