Chemical Properties of 1-Phenyl-1-octyne

1-Phenyl-1-octyne

InChI
InChI=1S/C14H18/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14/h7,9-10,12-13H,2-6H2,1H3
InChI Key
YVCYLGYUDUYFQZ-UHFFFAOYSA-N
Formula
C14H18
SMILES
CCCCCCC#Cc1ccccc1
Molecular Weight1
186.30
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Physical Properties

Property Value Unit Source
ω 0.4570 Relay (1.0) Calculated Property
ΔfH°gas 192.36 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 29.18 kJ/mol Joback Calculated Property
ΔvapH° 65.22 kJ/mol Relay (1.0) Calculated Property
IE 8.29 eV Relay (1.0) Calculated Property
log10WS -5.28 Relay (1.0) Calculated Property
logPoct/wat 4.008 Crippen Calculated Property
McVol 175.760 ml/mol McGowan Calculated Property
Pc 2331.52 kPa Joback Calculated Property
Tboil 525.80 K Relay (1.0) Calculated Property
Tc 736.15 K Relay (1.0) Calculated Property
Tfus 236.88 K Relay (1.0) Calculated Property
Vc 0.652 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [406.30; 497.82] J/mol×K [555.60; 774.00] Show Hide
Cp,gas 406.30 J/mol×K 555.60 Joback Calculated Property
Cp,gas 424.00 J/mol×K 592.00 Joback Calculated Property
Cp,gas 440.66 J/mol×K 628.40 Joback Calculated Property
Cp,gas 456.33 J/mol×K 664.80 Joback Calculated Property
Cp,gas 471.05 J/mol×K 701.20 Joback Calculated Property
Cp,gas 484.86 J/mol×K 737.60 Joback Calculated Property
Cp,gas 497.82 J/mol×K 774.00 Joback Calculated Property

Similar Compounds

1-Phenyl-1-nonyne. 1-Phenyl-1-heptyne. Benzene, 1-hexynyl-. 1-Phenyl-1-pentyne. Naphtho[1,8',8:c,d]cyclododeca-1,6-diyne. Naphtho[1,8',8:c,d]cycloundeca-1,5-diyne. 6-Phenyl-5-hexyn-3-ol. Naphtho[1,8',8:c,d]cyclodeca-1,5-diiyne. Isovalerylphenylacetylene. 7H-Dibenzo-8,9,10,11-tetrahydro-. Benzene, 1-butynyl-. Dibenzo[a,c]cyclododecene, 5,6,11,12-tetradehydro-7,8,9,10-tetrahydro-. 1-Phenylpenta-1-yn-3-one. 1-(Phenylethynyl)-1-cyclopentanol. 1-Phenyloct-2-yn-1-ol.

Find more compounds similar to 1-Phenyl-1-octyne.

Sources

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