ChemSpider 2D Image | (5Z,20Z,22Z)-3,6,20,23-Tetraazaheptacyclo[24.8.2.2~8,17~.1~2,32~.1~7,11~.0~14,19~.0~24,29~]tetraconta-1,3,5,7(40),8,10,14,16,18,20,22,24,26,28,32(37),33-hexadecaene | C36H32N4

(5Z,20Z,22Z)-3,6,20,23-Tetraazaheptacyclo[24.8.2.28,17.12,32.17,11.014,19.024,29]tetraconta-1,3,5,7(40),8,10,14,16,18,20,22,24,26,28,32(37),33-hexadecaene

  • Molecular FormulaC36H32N4
  • Average mass520.666 Da
  • Monoisotopic mass520.262695 Da
  • ChemSpider ID30659356

  • Double-bond stereo - Double-bond stereo

More details:

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

(5Z,20Z,22Z)-3,6,20,23-Tetraazaheptacyclo[24.8.2.28,17.12,32.17,11.014,19.024,29]tetraconta-1,3,5,7(40),8,10,14,16,18,20,22,24,26,28,32(37),33-hexadecaen [German] [ACD/IUPAC Name]
(5Z,20Z,22Z)-3,6,20,23-Tetraazaheptacyclo[24.8.2.28,17.12,32.17,11.014,19.024,29]tetraconta-1,3,5,7(40),8,10,14,16,18,20,22,24,26,28,32(37),33-hexadecaene [ACD/IUPAC Name]
(5Z,20Z,22Z)-3,6,20,23-Tétraazaheptacyclo[24.8.2.28,17.12,32.17,11.014,19.024,29]tétraconta-1,3,5,7(40),8,10,14,16,18,20,22,24,26,28,32(37),33-hexadécaène [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.681
Molar Refractivity: 162.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 8.34
ACD/LogD (pH 5.5): 7.89
ACD/BCF (pH 5.5): 579648.88
ACD/KOC (pH 5.5): 463924.34
ACD/LogD (pH 7.4): 7.89
ACD/BCF (pH 7.4): 581494.94
ACD/KOC (pH 7.4): 465401.81
Polar Surface Area: 49 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 49.2±7.0 dyne/cm
Molar Volume: 430.5±7.0 cm3

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