Chemical Properties of Undec-10-ynoic acid, 2-methyloct-5-yn-4-yl ester

Undec-10-ynoic acid, 2-methyloct-5-yn-4-yl ester

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InChI
InChI=1S/C20H32O2/c1-5-7-9-10-11-12-13-14-16-20(21)22-19(15-8-6-2)17-18(3)4/h1,18-19H,6-7,9-14,16-17H2,2-4H3
InChI Key
VWPUMBYYXCXPPZ-UHFFFAOYSA-N
Formula
C20H32O2
SMILES
C#CCCCCCCCCC(=O)OC(C#CCC)CC(C)C
Molecular Weight1
304.47
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Physical Properties

Property Value Unit Source
Δf 304.59 kJ/mol Joback Calculated Property
Δfgas -147.29 kJ/mol Joback Calculated Property
Δfus 49.39 kJ/mol Joback Calculated Property
Δvap 70.50 kJ/mol Joback Calculated Property
log10WS -6.52 Crippen Calculated Property
logPoct/wat 5.112 Crippen Calculated Property
McVol 282.900 ml/mol McGowan Calculated Property
Pc 1305.17 kPa Joback Calculated Property
Inp [2049.00; 2049.00]   Show Hide
Inp 2049.00 NIST
Inp 2049.00 NIST
Tboil 731.53 K Joback Calculated Property
Tc 922.70 K Joback Calculated Property
Tfus 510.39 K Joback Calculated Property
Vc 1.091 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [812.26; 910.12] J/mol×K [731.53; 922.70] Show Hide
Cp,gas 812.26 J/mol×K 731.53 Joback Calculated Property
Cp,gas 830.90 J/mol×K 763.39 Joback Calculated Property
Cp,gas 848.57 J/mol×K 795.25 Joback Calculated Property
Cp,gas 865.30 J/mol×K 827.12 Joback Calculated Property
Cp,gas 881.11 J/mol×K 858.98 Joback Calculated Property
Cp,gas 896.04 J/mol×K 890.84 Joback Calculated Property
Cp,gas 910.12 J/mol×K 922.70 Joback Calculated Property

Similar Compounds

Octanoic acid, 2-methyloct-5-yn-4-yl ester. Hexanoic acid, 2-methyloct-5-yn-4-yl ester. Sebacic acid, 2-methyloct-5-yn-4-yl propyl ester. Valeric acid, 2-methyloct-5-yn-4-yl ester. Sebacic acid, butyl 2-methyloct-5-yn-4-yl ester. Sebacic acid, 2-methyloct-5-yn-4-yl undecyl ester. Sebacic acid, 2-methyloct-5-yn-4-yl pentyl ester. Sebacic acid, heptyl 2-methyloct-5-yn-4-yl ester. Sebacic acid, 2-methyloct-5-yn-4-yl octyl ester. Sebacic acid, 2-methyloct-5-yn-4-yl nonyl ester. 3-Cyclopentylpropionic acid, 2-methyloct-5-yn-4-yl ester. Sebacic acid, isobutyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, di(2-methyloct-5-yn-4-yl) ester. Glutaric acid, 2-methyloct-5-yn-4-yl nonyl ester. Glutaric acid, heptadecyl 2-methyloct-5-yn-4-yl ester.

Find more compounds similar to Undec-10-ynoic acid, 2-methyloct-5-yn-4-yl ester.

Sources

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