ChemSpider 2D Image | (1Z,10Z,19Z)-28,29,30,31,32,33-Hexaazaheptacyclo[22.3.1.1~2,5~.1~6,10~.1~11,14~.1~15,19~.1~20,23~]tritriaconta-1,3,5(33),6,8,10,12,14(31),15,17,19,21,23(29),24,26-pentadecaene | C27H18N6

(1Z,10Z,19Z)-28,29,30,31,32,33-Hexaazaheptacyclo[22.3.1.12,5.16,10.111,14.115,19.120,23]tritriaconta-1,3,5(33),6,8,10,12,14(31),15,17,19,21,23(29),24,26-pentadecaene

  • Molecular FormulaC27H18N6
  • Average mass426.472 Da
  • Monoisotopic mass426.159302 Da
  • ChemSpider ID74118790

  • Double-bond stereo - Double-bond stereo

More details:

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

(1Z,10Z,19Z)-28,29,30,31,32,33-Hexaazaheptacyclo[22.3.1.12,5.16,10.111,14.115,19.120,23]tritriaconta-1,3,5(33),6,8,10,12,14(31),15,17,19,21,23(29),24,26-pentadecaen [German] [ACD/IUPAC Name]
(1Z,10Z,19Z)-28,29,30,31,32,33-Hexaazaheptacyclo[22.3.1.12,5.16,10.111,14.115,19.120,23]tritriaconta-1,3,5(33),6,8,10,12,14(31),15,17,19,21,23(29),24,26-pentadecaene [ACD/IUPAC Name]
(1Z,10Z,19Z)-28,29,30,31,32,33-Hexaazaheptacyclo[22.3.1.12,5.16,10.111,14.115,19.120,23]tritriaconta-1,3,5(33),6,8,10,12,14(31),15,17,19,21,23(29),24,26-pentadécaène [French] [ACD/IUPAC Name]
28,29,30,31,32,33-Hexaazaheptacyclo[22.3.1.12,5.16,10.111,14.115,19.120,23]tritriaconta-1,3,5(33),6,8,10,12,14(31),15,17,19,21,23(29),24,26-pentadecaene, (1Z,10Z,19Z)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 888.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 129.2±3.0 kJ/mol
Flash Point: 491.3±34.3 °C
Index of Refraction: 1.810
Molar Refractivity: 127.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -3.52
ACD/LogD (pH 5.5): -6.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 62.8±7.0 dyne/cm
Molar Volume: 295.5±7.0 cm3

Click to predict properties on the Chemicalize site


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