ChemSpider 2D Image | N'-[(E)-(16,18-Dioxo-17-phenyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-1-yl)methylene]-1,3-benzodioxole-5-carbohydrazide | C33H23N3O5

N'-[(E)-(16,18-Dioxo-17-phenyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-1-yl)methylene]-1,3-benzodioxole-5-carbohydrazide

  • Molecular FormulaC33H23N3O5
  • Average mass541.553 Da
  • Monoisotopic mass541.163757 Da
  • ChemSpider ID7925038

  • Double-bond stereo - Double-bond stereo

More details:

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

N'-[(E)-(16,18-Dioxo-17-phenyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-1-yl)methylen]-1,3-benzodioxol-5-carbohydrazid [German] [ACD/IUPAC Name]
N'-[(E)-(16,18-Dioxo-17-phenyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-1-yl)methylene]-1,3-benzodioxole-5-carbohydrazide [ACD/IUPAC Name]
N'-[(E)-(16,18-Dioxo-17-phényl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadéca-2,4,6,9,11,13-hexaén-1-yl)méthylène]-1,3-benzodioxole-5-carbohydrazide [French] [ACD/IUPAC Name]
N-[(1E)-2-(16,18-dioxo-17-phenyl-17-azapentacyclo[6.6.5.0<2,7>.0<9,14>.0<15,19>]nonadeca-2,4,6,9,11,13-hexaenyl)-1-azavinyl]-2H-benzo[3,4-d]1,3-dioxolen-5-ylcarboxamide
N'-[(E)-(16,18-dioxo-17-phenyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-1-yl)methylidene]-1,3-benzodioxole-5-carbohydrazide (non-preferred name)
noname

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.759
Molar Refractivity: 150.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 1218.97
ACD/KOC (pH 5.5): 5630.58
ACD/LogD (pH 7.4): 4.36
ACD/BCF (pH 7.4): 1218.93
ACD/KOC (pH 7.4): 5630.39
Polar Surface Area: 97 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 64.3±7.0 dyne/cm
Molar Volume: 365.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement