Chemical Properties of 1,2,4,5-[2.2.2.2]Cyclophane (CAS 54100-59-3)

1,2,4,5-[2.2.2.2]Cyclophane

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InChI
InChI=1S/C20H20/c1-2-14-10-18-6-5-16-9-13(1)15-3-4-17(14)12-20(18)8-7-19(16)11-15/h9-12H,1-8H2
InChI Key
VKBBYQHRVDUAIS-UHFFFAOYSA-N
Formula
C20H20
SMILES
c1c2c3cc4c1CCc1cc(c(cc1CC4)CC3)CC2
Molecular Weight1
260.37
CAS
54100-59-3
Other Names
  • [2.2.2.2](1,2,4,5)Cyclophane
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Physical Properties

Property Value Unit Source
Δf 502.04 kJ/mol Joback Calculated Property
Δfgas 233.69 kJ/mol Joback Calculated Property
Δfus 26.60 kJ/mol Joback Calculated Property
Δvap 69.13 kJ/mol Joback Calculated Property
IE [7.35; 7.67] eV Show Hide
IE 7.35 eV NIST
IE 7.67 ± 0.02 eV NIST
log10WS -5.88 Crippen Calculated Property
logPoct/wat 3.768 Crippen Calculated Property
McVol 212.560 ml/mol McGowan Calculated Property
Pc 2263.26 kPa Joback Calculated Property
Tboil 770.20 K Joback Calculated Property
Tc 1024.71 K Joback Calculated Property
Tfus 513.18 K Joback Calculated Property
Vc 0.822 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [625.77; 722.18] J/mol×K [770.20; 1024.71] Show Hide
Cp,gas 625.77 J/mol×K 770.20 Joback Calculated Property
Cp,gas 643.53 J/mol×K 812.62 Joback Calculated Property
Cp,gas 660.28 J/mol×K 855.04 Joback Calculated Property
Cp,gas 676.27 J/mol×K 897.45 Joback Calculated Property
Cp,gas 691.75 J/mol×K 939.87 Joback Calculated Property
Cp,gas 706.97 J/mol×K 982.29 Joback Calculated Property
Cp,gas 722.18 J/mol×K 1024.71 Joback Calculated Property
η [0.0017968; 0.0033005] Pa×s [513.18; 770.20] Show Hide
η 0.0033005 Pa×s 513.18 Joback Calculated Property
η 0.0028682 Pa×s 556.02 Joback Calculated Property
η 0.0025431 Pa×s 598.85 Joback Calculated Property
η 0.0022914 Pa×s 641.69 Joback Calculated Property
η 0.0020916 Pa×s 684.53 Joback Calculated Property
η 0.0019300 Pa×s 727.36 Joback Calculated Property
η 0.0017968 Pa×s 770.20 Joback Calculated Property

Similar Compounds

2,5,3',6'-Tetramethyl-[2.2]paracyclophane. [2.2.2.2.2](1,2,3,4,5)Cyclophane. [2.2.2](1,2,4)Cyclophane. Pentacyclo[18.2.2.2(9,12).0(4,15).0(6,17)]hexacosa-4,6(17),9,11,15,20,22,23,25-nonane. [2.2.2.2](1,2,3,5)Cyclophane. Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene, 5,15-dimethyl-. [2.2.2.2](1,2,3,4)Cyclophane. Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene, 5,12-dimethyl-. 2-Methyl[2.2]paracyclophane. Tricyclo[8.2.2.2<sup>4,7</sup>]hexadeca-4,6,10,12,13,15-hexaene,5,11,13,15-tetramethyl-,stereoisomer. 2,3,5',6'-Tetramethyl-[2.2]paracyclophane. Tricyclo[8.2.2.2<sup>4,7</sup>]hexadeca-6,10,12,13,15-hexaene, 5,6,11,12,13,15-hexamethyl-. Dibenzo[a,e]cyclooctene, 5,6,11,12-tetrahydro-. Benzene, 1,1'-(1,2-ethanediyl)bis[2-methyl-. Benzene, 1,2,4,5-tetraethyl-.

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