Chemical Properties of Pentadecafluorooctanoic acid, 2,7-dimethyloct-1-en-3-yn-5-yl ester

Pentadecafluorooctanoic acid, 2,7-dimethyloct-1-en-3-yn-5-yl ester

InChI
InChI=1S/C18H15F15O2/c1-8(2)5-6-10(7-9(3)4)35-11(34)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)33/h9-10H,1,7H2,2-4H3
InChI Key
NFZUCRFRZSIQAT-UHFFFAOYSA-N
Formula
C18H15F15O2
SMILES
C=C(C)C#CC(CC(C)C)OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
548.29
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Physical Properties

Property Value Unit Source
ω 0.6668 Relay (1.0) Calculated Property
ΔfG° -2758.30 kJ/mol Joback Calculated Property
ΔfH°gas -3395.47 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 32.95 kJ/mol Joback Calculated Property
ΔvapH° 78.28 kJ/mol Relay (1.0) Calculated Property
IE 9.86 eV Relay (1.0) Calculated Property
log10WS -8.31 Relay (1.0) Calculated Property
logPoct/wat 6.898 Crippen Calculated Property
McVol 285.570 ml/mol McGowan Calculated Property
Pc 965.07 kPa Joback Calculated Property
Inp 1277.00 NIST
Tboil 507.05 K Relay (1.0) Calculated Property
Tc 641.96 K Relay (1.0) Calculated Property
Tfus 317.72 K Relay (1.0) Calculated Property
Vc 1.084 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [858.57; 927.84] J/mol×K [658.65; 815.06] Show Hide
Cp,gas 858.57 J/mol×K 658.65 Joback Calculated Property
Cp,gas 872.33 J/mol×K 684.72 Joback Calculated Property
Cp,gas 885.10 J/mol×K 710.79 Joback Calculated Property
Cp,gas 896.96 J/mol×K 736.85 Joback Calculated Property
Cp,gas 907.98 J/mol×K 762.92 Joback Calculated Property
Cp,gas 918.25 J/mol×K 788.99 Joback Calculated Property
Cp,gas 927.84 J/mol×K 815.06 Joback Calculated Property

Similar Compounds

Pentadecafluorooctanoic acid, 2-methyloct-5-en-4-yl ester. Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Pentadecafluorooctanoic acid, 4-methyl-2-pentyl ester. Succinic acid, 2,2,3,3-tetrafluoropropyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Sebacic acid, 2,7-dimethylocta-7-en-5-yn-4-yl pentyl ester. Sebacic acid, 2,7-dimethylocta-7-en-5-yn-4-yl hexyl ester. Sebacic acid, 2,7-dimethylocta-7-en-5-yn-4-yl heptyl ester. 3-Phenylpropionic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl isohexyl ester. Cyclobutanecarboxylic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2-methyloct-5-yn-4-yl ester. Sebacic acid, 2,7-dimethylocta-7-en-5-yn-4-yl isobutyl ester. Glutaric acid, 8-chlorooctyl 2,6-dimethylnon-1-en-3-yn-5-yl ester.

Find more compounds similar to Pentadecafluorooctanoic acid, 2,7-dimethyloct-1-en-3-yn-5-yl ester.

Sources

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