Chemical Properties of BUTANOIC ACID, 2-ETHYLHEXYL ESTER (CAS 25415-84-3)

BUTANOIC ACID, 2-ETHYLHEXYL ESTER

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InChI
InChI=1S/C12H24O2/c1-4-7-9-11(6-3)10-14-12(13)8-5-2/h11H,4-10H2,1-3H3
InChI Key
LFEQNZNCKDNGRM-UHFFFAOYSA-N
Formula
C12H24O2
SMILES
CCCCC(CC)COC(=O)CCC
Molecular Weight1
200.32
CAS
25415-84-3
Other Names
  • 2-Ethylhexyl butyrate
  • Butanoic acid, 2-ethylhexyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -186.20 kJ/mol Joback Calculated Property
Δfgas -541.09 kJ/mol Joback Calculated Property
Δfus 26.10 kJ/mol Joback Calculated Property
Δvap 51.07 kJ/mol Joback Calculated Property
logPoct/wat 3.55 Crippen Calculated Property
Pc 1864.33 kPa Joback Calculated Property
Tboil 549.81 K Joback Calculated Property
Tc 722.69 K Joback Calculated Property
Tfus 282.16 K Joback Calculated Property
Vc 0.73 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 464.44 J/mol×K 549.81 Joback Calculated Property
η 0.00 Pa×s 549.81 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Propanoic acid, 2-ethylhexyl ester. 2-Ethylhexyl pentanoate. 2-Ethylhexyl caproate. 2-Ethylhexyl heptanoate. Pimelic acid, 2-ethylhexyl heptyl ester. Pimelic acid, 2-ethylhexyl hexyl ester. Pimelic acid, 2-ethylhexyl pentyl ester. Pimelic acid, butyl 2-ethylhexyl ester. Pimelic acid, di(2-ethylhexyl) ester. Pimelic acid, 2-ethylhexyl isobutyl ester. Sebacic acid, 2-ethylhexyl octyl ester. Sebacic acid, dodecyl 2-ethylhexyl ester. Pimelic acid, 2-ethylhexyl octyl ester. Sebacic acid, 2-ethylhexyl undecyl ester. 2-Ethylhexyl nonanoate.

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