Chemical Properties of 5,6,11,12-Tetraphenylnaphthacene (CAS 517-51-1)

5,6,11,12-Tetraphenylnaphthacene

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InChI
InChI=1S/C42H28/c1-5-17-29(18-6-1)37-33-25-13-14-26-34(33)39(31-21-9-3-10-22-31)42-40(32-23-11-4-12-24-32)36-28-16-15-27-35(36)38(41(37)42)30-19-7-2-8-20-30/h1-28H
InChI Key
YYMBJDOZVAITBP-UHFFFAOYSA-N
Formula
C42H28
SMILES
c1ccc(-c2c3ccccc3c(-c3ccccc3)c3c(-c4ccccc4)c4ccccc4c(-c4ccccc4)c23)cc1
Molecular Weight1
532.67
CAS
517-51-1
Other Names
  • 5,6,11,12-Tetraphenyltetracene
  • Naphthacene, 5,6,11,12-tetraphenyl-
  • Rubren
  • Rubrene
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Physical Properties

Property Value Unit Source
Δcsolid -21149.00 ± 21.00 kJ/mol NIST
Δf 1126.98 kJ/mol Joback Calculated Property
Δfgas 882.00 kJ/mol NIST
Δfsolid [620.00; 620.00] kJ/mol Show Hide
Δfsolid 620.00 ± 22.00 kJ/mol NIST
Δfsolid 620.00 ± 21.00 kJ/mol NIST
Δfus 63.46 kJ/mol Joback Calculated Property
Δsub 262.00 kJ/mol NIST
Δvap 129.36 kJ/mol Joback Calculated Property
IE 6.41 eV NIST
log10WS -17.30 Crippen Calculated Property
logPoct/wat 11.814 Crippen Calculated Property
McVol 425.460 ml/mol McGowan Calculated Property
Pc 1149.10 kPa Joback Calculated Property
Tboil 1380.58 K Joback Calculated Property
Tc 1695.98 K Joback Calculated Property
Tfus 868.42 K Joback Calculated Property
Vc 1.613 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1493.96; 1755.33] J/mol×K [1380.58; 1695.98] Show Hide
Cp,gas 1493.96 J/mol×K 1380.58 Joback Calculated Property
Cp,gas 1526.79 J/mol×K 1433.15 Joback Calculated Property
Cp,gas 1563.09 J/mol×K 1485.71 Joback Calculated Property
Cp,gas 1603.47 J/mol×K 1538.28 Joback Calculated Property
Cp,gas 1648.56 J/mol×K 1590.85 Joback Calculated Property
Cp,gas 1698.97 J/mol×K 1643.42 Joback Calculated Property
Cp,gas 1755.33 J/mol×K 1695.98 Joback Calculated Property
η [0.0000771; 0.0003065] Pa×s [868.42; 1380.58] Show Hide
η 0.0003065 Pa×s 868.42 Joback Calculated Property
η 0.0002197 Pa×s 953.78 Joback Calculated Property
η 0.0001663 Pa×s 1039.14 Joback Calculated Property
η 0.0001313 Pa×s 1124.50 Joback Calculated Property
η 0.0001072 Pa×s 1209.86 Joback Calculated Property
η 0.0000899 Pa×s 1295.22 Joback Calculated Property
η 0.0000771 Pa×s 1380.58 Joback Calculated Property
ΔsubH [160.60; 162.80] kJ/mol [453.00; 488.00] Show Hide
ΔsubH 162.80 ± 4.20 kJ/mol 453.00 NIST
ΔsubH 160.60 ± 4.20 kJ/mol 488.00 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [660.66; 852.18] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A2.26410e+01
Coefficient B-1.47679e+04
Temperature range, min.660.66
Temperature range, max.852.18
Pvap 1.33 kPa 660.66 Calculated Property
Pvap 2.68 kPa 681.94 Calculated Property
Pvap 5.16 kPa 703.22 Calculated Property
Pvap 9.56 kPa 724.50 Calculated Property
Pvap 17.10 kPa 745.78 Calculated Property
Pvap 29.62 kPa 767.06 Calculated Property
Pvap 49.80 kPa 788.34 Calculated Property
Pvap 81.49 kPa 809.62 Calculated Property
Pvap 130.01 kPa 830.90 Calculated Property
Pvap 202.64 kPa 852.18 Calculated Property

Similar Compounds

Anthracene, 9,10-diphenyl-. Anthracene, 9,10-di-1-naphthyl-. Naphthalene, 1,7-diphenyl-. Anthracene, 9-phenyl-. Pyrene, 1-phenyl-. 1-phenylphenanthrene. Phenanthrene, 9-phenyl-. 1,2'-Binaphthalene. Naphthalene, 1-phenyl-. Indeno[1,2,3-fg]naphthacene. 1,1'-Binaphthalene. Binaphthalene. Phenanthrene, 9,10-diphenyl-. 9,9'-Biphenanthrene. Dibenzo[j,l]fluoranthene.

Find more compounds similar to 5,6,11,12-Tetraphenylnaphthacene.

Sources

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