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

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

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InChI
InChI=1S/C17H22O3/c1-5-6-9-14(12-13(2)3)20-17(18)15-10-7-8-11-16(15)19-4/h7-8,10-11,13-14H,5,12H2,1-4H3
InChI Key
DKGCROILSHCXBK-UHFFFAOYSA-N
Formula
C17H22O3
SMILES
CCC#CC(CC(C)C)OC(=O)c1ccccc1OC
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 [1944.40; 1944.40]   Show Hide
Inp 1944.40 NIST
Inp 1944.40 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

o-Anisic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. m-Anisic acid, 2-methyloct-5-yn-4-yl ester. p-Anisic acid, 2-methyloct-5-yn-4-yl ester. o-Anisic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. p-Anisic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2-Methoxybenzoic acid, 1,4-dimethylpentyl ester. o-Anisic acid, hex-4-yn-3-yl ester. m-Anisic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, 2,7-dimethyloct-7-en-5-yn-4-yl pentyl ester. 2-Chlorobenzoic acid, 2-methyloct-5-yn-4-yl ester. Isophthalic acid, 2,7-dimethyloct-7-en-5-yn-4-yl hexyl ester. Isophthalic acid, butyl 2,7-dimethyloct-7-en-5-yn-4-yl ester. Isophthalic acid, 2,7-dimethyloct-7-en-5-yn-4-yl isohexyl ester. Isophthalic acid, 2-methyloct-5-yn-4-yl pentyl ester. Isophthalic acid, 2,7-dimethyloct-7-en-5-yn-4-yl heptyl ester.

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

Sources

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