Chemical Properties of 4-Ethylbenzoic acid, dodec-9-ynyl ester

4-Ethylbenzoic acid, dodec-9-ynyl ester

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InChI
InChI=1S/C21H30O2/c1-3-5-6-7-8-9-10-11-12-13-18-23-21(22)20-16-14-19(4-2)15-17-20/h14-17H,3-4,7-13,18H2,1-2H3
InChI Key
KAZMWHCOWVPOMU-UHFFFAOYSA-N
Formula
C21H30O2
SMILES
CCC#CCCCCCCCCOC(=O)c1ccc(CC)cc1
Molecular Weight1
314.46
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Physical Properties

Property Value Unit Source
Δf 197.60 kJ/mol Joback Calculated Property
Δfgas -224.21 kJ/mol Joback Calculated Property
Δfus 49.71 kJ/mol Joback Calculated Property
Δvap 76.59 kJ/mol Joback Calculated Property
log10WS -6.92 Crippen Calculated Property
logPoct/wat 5.550 Crippen Calculated Property
McVol 281.830 ml/mol McGowan Calculated Property
Pc 1359.63 kPa Joback Calculated Property
Inp [2460.30; 2460.30]   Show Hide
Inp 2460.30 NIST
Inp 2460.30 NIST
Tboil 796.83 K Joback Calculated Property
Tc 1001.35 K Joback Calculated Property
Tfus 543.63 K Joback Calculated Property
Vc 1.089 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [836.53; 928.06] J/mol×K [796.83; 1001.35] Show Hide
Cp,gas 836.53 J/mol×K 796.83 Joback Calculated Property
Cp,gas 854.43 J/mol×K 830.92 Joback Calculated Property
Cp,gas 871.22 J/mol×K 865.00 Joback Calculated Property
Cp,gas 886.94 J/mol×K 899.09 Joback Calculated Property
Cp,gas 901.63 J/mol×K 933.18 Joback Calculated Property
Cp,gas 915.32 J/mol×K 967.27 Joback Calculated Property
Cp,gas 928.06 J/mol×K 1001.35 Joback Calculated Property

Similar Compounds

4-Ethylbenzoic acid, octyl ester. 4-Ethylbenzoic acid, hexadecyl ester. 4-Ethylbenzoic acid, undecyl ester. 4-Ethylbenzoic acid, nonyl ester. 4-Ethylbenzoic acid, octadecyl ester. 4-Ethylbenzoic acid, heptadecyl ester. 4-Ethylbenzoic acid, pentadecyl ester. 4-Ethylbenzoic acid, tridecyl ester. 4-Ethylbenzoic acid, tetradecyl ester. 4-Ethylbenzoic acid, decyl ester. 4-Ethylbenzoic acid, heptyl ester. 4-Ethylbenzoic acid, hexyl ester. 4-Ethylbenzoic acid, pentyl ester. 4-Butylbenzoic acid, dodec-9-ynyl ester. p-Toluic acid, dodec-9-ynyl ester.

Find more compounds similar to 4-Ethylbenzoic acid, dodec-9-ynyl ester.

Sources

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