Chemical Properties of 4-Ethylbenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester

4-Ethylbenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester

InChI
InChI=1S/C20H26O2/c1-6-8-16(5)19(14-9-15(3)4)22-20(21)18-12-10-17(7-2)11-13-18/h10-13,16,19H,3,6-8H2,1-2,4-5H3
InChI Key
RCCWFOTWJIIRJG-UHFFFAOYSA-N
Formula
C20H26O2
SMILES
C=C(C)C#CC(OC(=O)c1ccc(CC)cc1)C(C)CCC
Molecular Weight1
298.42
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Physical Properties

Property Value Unit Source
ΔfusH° 39.06 kJ/mol Joback Calculated Property
logPoct/wat 4.790 Crippen Calculated Property
McVol 263.440 ml/mol McGowan Calculated Property
Inp [2087.80; 2087.80]   Show Hide
Inp 2087.80 NIST
Inp 2087.80 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [364.20; 848.86] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A2.02300e+00
Coefficient B1.55258e+00
Coefficient C-8.73220e-04
Coefficient D1.67480e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 364.20 J/mol×K 273.00 Calculated Property
Cp,gas 449.42 J/mol×K 353.78 Calculated Property
Cp,gas 525.55 J/mol×K 434.56 Calculated Property
Cp,gas 593.14 J/mol×K 515.33 Calculated Property
Cp,gas 652.71 J/mol×K 596.11 Calculated Property
Cp,gas 704.80 J/mol×K 676.89 Calculated Property
Cp,gas 749.93 J/mol×K 757.67 Calculated Property
Cp,gas 788.63 J/mol×K 838.44 Calculated Property
Cp,gas 821.43 J/mol×K 919.22 Calculated Property
Cp,gas 848.86 J/mol×K 1000.00 Calculated Property

Similar Compounds

4-Butylbenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. p-Toluic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. m-Toluic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. o-Toluic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 4-(Ttifluoromethyl)benzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 4-Ethylbenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 4-Cyanobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, di(2,6-dimethylnon-1-en-3-yn-5-yl) ester. Isophthalic acid, 2,6-dimethylnon-1-en-3-yn-5-yl pentyl ester. Isophthalic acid, butyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, 2,6-dimethylnon-1-en-3-yn-5-yl propyl ester. 3-Trifluoromethylbenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 2-Trifluoromethylbenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ethyl ester. 4-butylbenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester.

Find more compounds similar to 4-Ethylbenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester.

Sources

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