Chemical Properties of Benzoic acid, 4-(1-methylpropyl)oxy-, methyl ester

Benzoic acid, 4-(1-methylpropyl)oxy-, methyl ester

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InChI
InChI=1S/C12H16O3/c1-4-9(2)15-11-7-5-10(6-8-11)12(13)14-3/h5-9H,4H2,1-3H3
InChI Key
HSFOKEFAEWVYQS-UHFFFAOYSA-N
Formula
C12H16O3
SMILES
CCC(C)Oc1ccc(C(=O)OC)cc1
Molecular Weight1
208.25
Sources

Physical Properties

Property Value Unit Source
Δf -188.42 kJ/mol Joback Calculated Property
Δfgas -448.25 kJ/mol Joback Calculated Property
Δfus 20.94 kJ/mol Joback Calculated Property
Δvap 56.42 kJ/mol Joback Calculated Property
logPoct/wat 2.65 Crippen Calculated Property
Pc 2458.04 kPa Joback Calculated Property
Tboil 603.89 K Joback Calculated Property
Tc 812.91 K Joback Calculated Property
Tfus 343.33 K Joback Calculated Property
Vc 0.64 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 419.73 J/mol×K 603.89 Joback Calculated Property
η 0.00 Pa×s 603.89 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 1
-CH3 3

Similar Compounds

Benzoic acid, 4-(isopropyl)oxy-, methyl ester. Benzoic acid, 4-propyloxy-, methyl ester. Benzoic acid, 4-(2-methylpropyl)oxy-, methyl ester. Benzoic acid, 4-(3-methylbutyl)oxy-, methyl ester. Benzoic acid, 4-pentyloxy-, methyl ester. Benzoic acid, 4-(neopentyl)oxy-, methyl ester. Methyl 4-octyloxybenzoate. Benzoic acid, 4-(2-methylbutyl)oxy-, methyl ester. Ethyl p-butoxybenzoate. Benzoic acid, 4-(1-methylpropyl)oxy-, 1-methylpropyl ester. Benzoic acid, 4-isopropyloxy-, isopropyl ester. Benzoic acid, 4-ethoxy-, ethyl ester. Benzoic acid, 4-methoxy-, methyl ester. Benzoic acid, 4-propyloxy-, propyl ester. 4-Propoxybenzoic acid.

Find more compounds similar to Benzoic acid, 4-(1-methylpropyl)oxy-, methyl ester.

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