Chemical Properties of Sebacic acid, geranyl hexyl ester

Sebacic acid, geranyl hexyl ester

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InChI
InChI=1S/C26H46O4/c1-5-6-7-14-21-29-25(27)18-12-10-8-9-11-13-19-26(28)30-22-20-24(4)17-15-16-23(2)3/h16,20H,5-15,17-19,21-22H2,1-4H3/b24-20+
InChI Key
YEDOSFOXPPZYGC-HIXSDJFHSA-N
Formula
C26H46O4
SMILES
CCCCCCOC(=O)CCCCCCCCC(=O)OCC=C(C)CCC=C(C)C
Molecular Weight1
422.64
Sources

Physical Properties

Property Value Unit Source
Δf -156.46 kJ/mol Joback Calculated Property
Δfgas -854.71 kJ/mol Joback Calculated Property
Δfus 66.45 kJ/mol Joback Calculated Property
Δvap 91.86 kJ/mol Joback Calculated Property
logPoct/wat 7.47 Crippen Calculated Property
Pc 812.61 kPa Joback Calculated Property
Tboil 954.94 K Joback Calculated Property
Tc 1170.88 K Joback Calculated Property
Tfus 489.02 K Joback Calculated Property
Vc 1.50 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1289.06 J/mol×K 954.94 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=C< 2
>C=O (nonring) 2
-CH2- 16
=CH- 2
-CH3 4

Similar Compounds

Sebacic acid, geranyl octyl ester. Sebacic acid, geranyl nonyl ester. Sebacic acid, decyl geranyl ester. Sebacic acid, geranyl undecyl ester. Sebacic acid, geranyl heptyl ester. Sebacic acid, geranyl pentyl ester. Sebacic acid, butyl geranyl ester. Sebacic acid, geranyl propyl ester. Sebacic acid, geranyl isohexyl ester. (E)-3,7-Dimethylocta-2,6-dien-1-yl stearate. (E)-3,7-Dimethylocta-2,6-dien-1-yl icosanoate. (Z)-3,7-Dimethylocta-2,6-dien-1-yl palmitate. (Z)-3,7-Dimethylocta-2,6-dien-1-yl dodecanoate. (E)-3,7-Dimethylocta-2,6-dien-1-yl dodecanoate. (E)-3,7-Dimethylocta-2,6-dien-1-yl decanoate.

Find more compounds similar to Sebacic acid, geranyl hexyl ester.

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