Chemical Properties of Hexanoic acid, 2-propyl, methyl ester

Hexanoic acid, 2-propyl, methyl ester

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InChI
InChI=1S/C10H20O2/c1-4-6-8-9(7-5-2)10(11)12-3/h9H,4-8H2,1-3H3
InChI Key
GXHTYYWMPPPKRZ-UHFFFAOYSA-N
Formula
C10H20O2
SMILES
CCCCC(CCC)C(=O)OC
Molecular Weight1
172.26
Sources

Physical Properties

Property Value Unit Source
Δf -203.04 kJ/mol Joback Calculated Property
Δfgas -499.81 kJ/mol Joback Calculated Property
Δfus 20.92 kJ/mol Joback Calculated Property
Δvap 46.62 kJ/mol Joback Calculated Property
logPoct/wat 2.77 Crippen Calculated Property
Pc 2216.62 kPa Joback Calculated Property
Tboil 504.05 K Joback Calculated Property
Tc 679.81 K Joback Calculated Property
Tfus 259.62 K Joback Calculated Property
Vc 0.61 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 368.31 J/mol×K 504.05 Joback Calculated Property
η 0.00 Pa×s 504.05 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH2- 5
>C=O (nonring) 1
-CH3 3

Similar Compounds

Hexanoic acid, 2-butyl-, methyl ester. Hexanoic acid, 2-ethyl-, methyl ester. Heptanoic acid, 2-propyl-, methyl ester. Dimethyl-2-ethylsuberate. Octanoic acid, 2-ethyl, methyl ester. Heptanoic acid, 2-ethyl-, methyl ester. Methyl cycloundecanecarboxylate. c-C6H11COOCH3. Dimethyl-2,5-diethyladipate. Methyl 2,6,10-trimethyltridecanoate. Pentadecanoic acid, 2,6,10,14-tetramethyl-, methyl ester. Pentanoic acid, 2-propyl-, methyl ester. Hexanoic acid, 2-ethyl-, ethyl ester. 1,4-Cyclohexanedicarboxylic acid, dimethyl ester. Pentanoic acid, 2-ethyl-, methyl ester.

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