Chemical Properties of 1,3,6-Cyclooctatriene (CAS 3725-30-2)

1,3,6-Cyclooctatriene

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InChI
InChI=1S/C8H10/c1-2-4-6-8-7-5-3-1/h1-4,7-8H,5-6H2/b3-1-,4-2-,8-7-
InChI Key
LHNSMWDERKGLJK-DKPWQKSPSA-N
Formula
C8H10
SMILES
C1=CCC=CCC=C1
Molecular Weight1
106.17
CAS
3725-30-2
Other Names
  • 1,4,6-Cyclooctatriene
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Physical Properties

Property Value Unit Source
Δf 114.32 kJ/mol Joback Calculated Property
Δfgas 196.30 kJ/mol NIST
Δfus 6.71 kJ/mol Joback Calculated Property
Δvap 35.36 kJ/mol Joback Calculated Property
IE 8.50 eV NIST
log10WS -2.63 Crippen Calculated Property
logPoct/wat 2.449 Crippen Calculated Property
McVol 99.820 ml/mol McGowan Calculated Property
Pc 3955.54 kPa Joback Calculated Property
Tboil 412.68 K Joback Calculated Property
Tc 638.83 K Joback Calculated Property
Tfus 214.00 ± 8.00 K NIST
Vc 0.359 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [170.70; 249.79] J/mol×K [412.68; 638.83] Show Hide
Cp,gas 170.70 J/mol×K 412.68 Joback Calculated Property
Cp,gas 186.04 J/mol×K 450.37 Joback Calculated Property
Cp,gas 200.49 J/mol×K 488.06 Joback Calculated Property
Cp,gas 214.07 J/mol×K 525.76 Joback Calculated Property
Cp,gas 226.79 J/mol×K 563.45 Joback Calculated Property
Cp,gas 238.69 J/mol×K 601.14 Joback Calculated Property
Cp,gas 249.79 J/mol×K 638.83 Joback Calculated Property
η [0.0001978; 0.0200035] Pa×s [186.78; 412.68] Show Hide
η 0.0200035 Pa×s 186.78 Joback Calculated Property
η 0.0048607 Pa×s 224.43 Joback Calculated Property
η 0.0017735 Pa×s 262.08 Joback Calculated Property
η 0.0008336 Pa×s 299.73 Joback Calculated Property
η 0.0004637 Pa×s 337.38 Joback Calculated Property
η 0.0002902 Pa×s 375.03 Joback Calculated Property
η 0.0001978 Pa×s 412.68 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 341.20 K 8.00 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.66] kPa [304.71; 445.50] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.41591e+01
Coefficient B-3.43935e+03
Coefficient C-5.67670e+01
Temperature range, min.304.71
Temperature range, max.445.50
Pvap 1.33 kPa 304.71 Calculated Property
Pvap 3.04 kPa 320.35 Calculated Property
Pvap 6.31 kPa 336.00 Calculated Property
Pvap 12.13 kPa 351.64 Calculated Property
Pvap 21.82 kPa 367.28 Calculated Property
Pvap 37.12 kPa 382.93 Calculated Property
Pvap 60.14 kPa 398.57 Calculated Property
Pvap 93.42 kPa 414.21 Calculated Property
Pvap 139.85 kPa 429.86 Calculated Property
Pvap 202.66 kPa 445.50 Calculated Property

Similar Compounds

1,3,5-Cycloheptatriene. 1-(E,Z,Z)-3,5,8-undecatetraene. 1,3,5,8-Undecatetraene. 1-(E,E,Z)-3,5,8-undecatetraene. 1,3,6-Octatriene. 1,3,6-Octatriene, E,Z. 1,3,6-Octatriene, (E,E)-. 1,4,7,10-Cyclododecatetraene. 1,3,6-Heptatriene. trans-3,cis-5-octadiene. trans-3,trans-5-octadiene. 3,5-Octadiene, (Z,Z)-. 3,5-Octadiene. 1,4-Cyclohexadiene. trans-3,cis-6-nonadiene.

Find more compounds similar to 1,3,6-Cyclooctatriene.

Sources

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