Chemical Properties of Methyl 2-ethoxybenzoate (CAS 3686-55-3)

Methyl 2-ethoxybenzoate

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InChI
InChI=1S/C10H12O3/c1-3-13-9-7-5-4-6-8(9)10(11)12-2/h4-7H,3H2,1-2H3
InChI Key
QAYQKAPOTVSWLS-UHFFFAOYSA-N
Formula
C10H12O3
SMILES
CCOc1ccccc1C(=O)OC
Molecular Weight1
180.20
CAS
3686-55-3
Other Names
  • Benzoic acid, o-ethoxy-, methyl ester
  • Methyl 2-ethoxybenzoate
  • Methyl o-ethoxybenzoate
  • R 172
  • R 172 (The insectifuge)
Sources

Physical Properties

Property Value Unit Source
Δf -202.82 kJ/mol Joback Calculated Property
Δfgas -401.69 kJ/mol Joback Calculated Property
Δfus 19.28 kJ/mol Joback Calculated Property
Δvap 52.36 kJ/mol Joback Calculated Property
logPoct/wat 1.87 Crippen Calculated Property
Pc 2976.29 kPa Joback Calculated Property
Tboil 558.57 K Joback Calculated Property
Tc 770.06 K Joback Calculated Property
Tfus 335.79 K Joback Calculated Property
Vc 0.53 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 323.98 J/mol×K 558.57 Joback Calculated Property
η 0.00 Pa×s 558.57 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Benzoic acid, 2-propyloxy-, methyl ester. Benzoic acid, 2-(isopropyl)oxy-, methyl ester. Salicylic acid, ethyl ether, ethyl ester. Benzoic acid, 2-(2-methylpropyl)oxy-, methyl ester. Benzoic acid, 2-(3-methylbutyl)oxy-, methyl ester. Benzoic acid, 2-methoxy-, methyl ester. Benzoic acid, 2-(1-methylpropyl)oxy-, methyl ester. Aspirin methyl ester. Benzoic acid, 2-(2-methylbutyl)oxy-, methyl ester. Salicylic acid, isopropyl ether, isopropyl ester. Benzoic acid, 2-ethoxy-. Salicylic acid, propyl ether, propyl ester. Benzoic acid, 2-methoxy-, ethyl ester. Salicylic acid, 2-methylpropyl ether, 2-methylpropyl ester. Salicylic acid, butyl ether, butyl ester.

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