ChemSpider 2D Image | Kekulene | C48H24

Kekulene

  • Molecular FormulaC48H24
  • Average mass600.704 Da
  • Monoisotopic mass600.187805 Da
  • ChemSpider ID4574217

More details:






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

15,23:16,22-Dimethenobenzo[6,7]phenanthro[3,2-a]naphtho[2,3-o]pentaphene [ACD/Index Name]
Kekulene [Wiki]
Tridecacyclo[26.18.2.03,44.06,43.08,41.011,40.013,38.016,37.018,35.021,34.023,32.026,31.029,46]octatetraconta-1(46),2,4,6(43),7,9,11(40),12,14,16(37),17,19,21(34),22,24,26,28,30, 32,35,38,41,44,47-tetracosaen [German] [ACD/IUPAC Name]
Tridecacyclo[26.18.2.03,44.06,43.08,41.011,40.013,38.016,37.018,35.021,34.023,32.026,31.029,46]octatetraconta-1(46),2,4,6(43),7,9,11(40),12,14,16(37),17,19,21(34),22,24,26,28,30, 32,35,38,41,44,47-tetracosaene [ACD/IUPAC Name]
Tridécacyclo[26.18.2.03,44.06,43.08,41.011,40.013,38.016,37.018,35.021,34.023,32.026,31.029,46]octatétraconta-1(46),2,4,6(43),7,9,11(40),12,14,16(37),17,19,21(34),22,24,26,28,30, 32,35,38,41,44,47-tétracosaène [French] [ACD/IUPAC Name]
Кекулен [Russian]
ケクレン [Japanese]
凯库勒烯 [Chinese]
[12]kekulene
15,23:16,22-di(metheno)naphtho[2,3-a]tetrapheno[3,2-o]pentaphene

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

CHEBI:32987 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 2.105
Molar Refractivity: 218.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 14.77
ACD/LogD (pH 5.5): 13.89
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.89
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 86.6±0.5 10-24cm3
Surface Tension: 85.8±3.0 dyne/cm
Molar Volume: 409.4±3.0 cm3

Click to predict properties on the Chemicalize site





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