Chemical Properties of Hexanoic acid, oct-3-en-2-yl ester

Hexanoic acid, oct-3-en-2-yl ester

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InChI
InChI=1S/C14H26O2/c1-4-6-8-10-11-13(3)16-14(15)12-9-7-5-2/h10-11,13H,4-9,12H2,1-3H3/b11-10+
InChI Key
FCIRXSXAXUSWOF-ZHACJKMWSA-N
Formula
C14H26O2
SMILES
CCCCC=CC(C)OC(=O)CCCCC
Molecular Weight1
226.35
Sources

Physical Properties

Property Value Unit Source
Δf -89.14 kJ/mol Joback Calculated Property
Δfgas -465.15 kJ/mol Joback Calculated Property
Δfus 31.48 kJ/mol Joback Calculated Property
Δvap 55.48 kJ/mol Joback Calculated Property
logPoct/wat 4.24 Crippen Calculated Property
Pc 1657.84 kPa Joback Calculated Property
Tboil 599.73 K Joback Calculated Property
Tc 776.52 K Joback Calculated Property
Tfus 299.62 K Joback Calculated Property
Vc 0.82 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 547.81 J/mol×K 599.73 Joback Calculated Property
η 0.00 Pa×s 599.73 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 3
-CH2- 7
=CH- 2
>C=O (nonring) 1

Similar Compounds

Sebacic acid, di(oct-3-en-2-yl) ester. Octanoic acid, oct-3-en-2-yl ester. Sebacic acid, oct-3-en-2-yl propyl ester. 6-Bromohexanoic acid, oct-3-en-2-yl ester. Sebacic acid, butyl oct-3-en-2-yl ester. Sebacic acid, hexyl oct-3-en-2-yl ester. Sebacic acid, oct-3-en-2-yl pentyl ester. Sebacic acid, oct-3-en-2-yl octyl ester. Sebacic acid, nonyl oct-3-en-2-yl ester. Undec-10-ynoic acid, oct-3-en-2-yl ester. Sebacic acid, isobutyl oct-3-en-2-yl ester. Butanoic acid, oct-3-en-2-yl ester. 5-Bromovaleric acid, oct-3-en-2-yl ester. Sebacic acid, isohexyl oct-3-en-2-yl ester. 5-Chlorovaleric acid, oct-3-en-2-yl ester.

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