Chemical Properties of Avenaciolide, 6-[2-(4-methylphenyl)ethyl]-4-demethylene

Avenaciolide, 6-[2-(4-methylphenyl)ethyl]-4-demethylene

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InChI
InChI=1S/C15H16O4/c1-9-2-4-10(5-3-9)6-7-12-11-8-13(16)19-14(11)15(17)18-12/h2-5,11-12,14H,6-8H2,1H3/t11-,12-,14-/m1/s1
InChI Key
JKERMARNKVNMQC-YRGRVCCFSA-N
Formula
C15H16O4
SMILES
Cc1ccc(CCC2OC(=O)C3OC(=O)CC23)cc1
Molecular Weight1
260.29
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Physical Properties

Property Value Unit Source
Δf -149.63 kJ/mol Joback Calculated Property
Δfgas -554.33 kJ/mol Joback Calculated Property
Δfus 36.38 kJ/mol Joback Calculated Property
Δvap 69.30 kJ/mol Joback Calculated Property
log10WS -2.76 Crippen Calculated Property
logPoct/wat 1.785 Crippen Calculated Property
McVol 191.610 ml/mol McGowan Calculated Property
Pc 2467.81 kPa Joback Calculated Property
Inp 2300.00 NIST
Tboil 781.15 K Joback Calculated Property
Tc 1033.01 K Joback Calculated Property
Tfus 511.93 K Joback Calculated Property
Vc 0.721 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [604.45; 686.20] J/mol×K [781.15; 1033.01] Show Hide
Cp,gas 604.45 J/mol×K 781.15 Joback Calculated Property
Cp,gas 621.95 J/mol×K 823.13 Joback Calculated Property
Cp,gas 637.88 J/mol×K 865.10 Joback Calculated Property
Cp,gas 652.26 J/mol×K 907.08 Joback Calculated Property
Cp,gas 665.09 J/mol×K 949.05 Joback Calculated Property
Cp,gas 676.40 J/mol×K 991.03 Joback Calculated Property
Cp,gas 686.20 J/mol×K 1033.01 Joback Calculated Property

Similar Compounds

Avenaciolide, 6-[2-(4-trifluoromethylphenyl)ethyl]-4-demethylene. Avenaciolide, 6-(2-phenylethyl)-4-demethylene. Avenaciolide, 6-[2-(4-fluorophenyl)ethyl]-4-demethylene. Avenaciolide, 6-[2-(4-chlorophenyl)ethyl]-4-demethylene. Avenaciolide, 6-[2-(3-chlorophenyl)ethyl]-4-demethylene. Avenaciolide, 6-[2-(3-bromophenyl)ethyl]-4-demethylene. Avenaciolide, 6-[2-(2-chlorophenyl)ethyl]-4-demethylene. Avenaciolide, 6-[2-(3-ethoxyphenyl)ethyl]-4-demethylene. Avenaciolide, 6-[2-(4-methylphenyl)ethyl]. Avenaciolide, 6-[2-(4-trifluoromethylphenyl)ethyl]. Avenaciolide, 6-[2-(4-chlorophenyl)ethyl]. Avenaciolide, 6-[2-(4-fluorophenyl)ethyl]. Avenaciolide, 6-(2-phenylethyl). Avenaciolide, 6-[2-(3-chlorophenyl)ethyl]. Avenaciolide, 6-[2-(2-chlorophenyl)ethyl].

Find more compounds similar to Avenaciolide, 6-[2-(4-methylphenyl)ethyl]-4-demethylene.

Sources

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