Chemical Properties of p-Anisic acid, 2-methyloct-5-yn-4-yl ester

p-Anisic acid, 2-methyloct-5-yn-4-yl ester

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InChI
InChI=1S/C17H22O3/c1-5-6-7-16(12-13(2)3)20-17(18)14-8-10-15(19-4)11-9-14/h8-11,13,16H,5,12H2,1-4H3
InChI Key
HGSPJWWGHRVXBB-UHFFFAOYSA-N
Formula
C17H22O3
SMILES
CCC#CC(CC(C)C)OC(=O)c1ccc(OC)cc1
Molecular Weight1
274.35
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Physical Properties

Property Value Unit Source
Δf 54.04 kJ/mol Joback Calculated Property
Δfgas -284.43 kJ/mol Joback Calculated Property
Δfus 33.49 kJ/mol Joback Calculated Property
Δvap 69.32 kJ/mol Joback Calculated Property
log10WS -4.85 Crippen Calculated Property
logPoct/wat 3.680 Crippen Calculated Property
McVol 231.340 ml/mol McGowan Calculated Property
Pc 1843.58 kPa Joback Calculated Property
Inp 1997.00 NIST
Tboil 726.85 K Joback Calculated Property
Tc 945.11 K Joback Calculated Property
Tfus 490.78 K Joback Calculated Property
Vc 0.872 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [638.93; 725.13] J/mol×K [726.85; 945.11] Show Hide
Cp,gas 638.93 J/mol×K 726.85 Joback Calculated Property
Cp,gas 656.04 J/mol×K 763.23 Joback Calculated Property
Cp,gas 672.03 J/mol×K 799.60 Joback Calculated Property
Cp,gas 686.92 J/mol×K 835.98 Joback Calculated Property
Cp,gas 700.73 J/mol×K 872.36 Joback Calculated Property
Cp,gas 713.46 J/mol×K 908.73 Joback Calculated Property
Cp,gas 725.13 J/mol×K 945.11 Joback Calculated Property

Similar Compounds

p-Anisic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. m-Anisic acid, 2-methyloct-5-yn-4-yl ester. o-Anisic acid, 2-methyloct-5-yn-4-yl ester. 4-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. Isophthalic acid, di(2-methyloct-5-yn-4-yl) ester. 4-Cyanobenzoic acid, 2-methyloct-5-yn-4-yl ester. o-Anisic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 4-Chlorobenzoic acid, 2-methyloct-5-yn-4-yl ester. Isophthalic acid, ethyl 2-methyloct-5-yn-4-yl ester. 3-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2-Bromobenzoic acid, 2-methyloct-5-yn-4-yl ester. p-Toluic acid, 2-methyloct-5-yn-4-yl ester. 4-Bromobenzoic acid, 2-methyloct-5-yn-4-yl ester. Isophthalic acid, butyl 2-methyloct-5-yn-4-yl ester. Isophthalic acid, isobutyl 2-methyloct-5-yn-4-yl ester.

Find more compounds similar to p-Anisic acid, 2-methyloct-5-yn-4-yl ester.

Sources

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