Chemical Properties of Diethyl 2-ethyl suberate (CAS 66827-01-8)

Diethyl 2-ethyl suberate

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InChI
InChI=1S/C14H26O4/c1-4-12(14(16)18-6-3)10-8-7-9-11-13(15)17-5-2/h12H,4-11H2,1-3H3
InChI Key
XCJIKPFWCGLRHU-UHFFFAOYSA-N
Formula
C14H26O4
SMILES
CCOC(=O)CCCCCC(CC)C(=O)OCC
Molecular Weight1
258.35
CAS
66827-01-8
Sources

Physical Properties

Property Value Unit Source
Δf -403.28 kJ/mol Joback Calculated Property
Δfgas -827.17 kJ/mol Joback Calculated Property
Δfus 34.07 kJ/mol Joback Calculated Property
Δvap 64.68 kJ/mol Joback Calculated Property
logPoct/wat 3.09 Crippen Calculated Property
Pc 1649.77 kPa Joback Calculated Property
Tboil 671.86 K Joback Calculated Property
Tc 850.20 K Joback Calculated Property
Tfus 376.86 K Joback Calculated Property
Vc 0.86 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 622.64 J/mol×K 671.86 Joback Calculated Property
η 0.00 Pa×s 671.86 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH2- 8
>C=O (nonring) 2
-CH3 3

Similar Compounds

Hexanoic acid, 2-ethyl-, ethyl ester. Ethyl cyclohexanecarboxylate. butyl 2-ethylnonanoate. Di-n-butyl-2-ethyl suberate. butyl 2-ethyldecanoate. Diethyl 2,5-diethyladipate. Cyclohexanecarboxylic acid, propyl ester. Hexanoic acid, 2-ethyl-, 2-methylpropyl ester. Butyl 2-ethylhexanoate. Di 2-ethyl hexyl 2-ethyl suberate. Octanoic acid, 2-methyl-, ethyl ester. ethyl 2-methyltetradecanoate. Diethyl-2,5-diethyl suberate. Cyclohexanecarboxylic acid, butyl ester. Cyclohexanecarboxylic acid, decyl ester.

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