Chemical Properties of Benzoic acid, 2-hydroxy-, ethyl ester (CAS 118-61-6)

Benzoic acid, 2-hydroxy-, ethyl ester

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InChI
InChI=1S/C9H10O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6,10H,2H2,1H3
InChI Key
GYCKQBWUSACYIF-UHFFFAOYSA-N
Formula
C9H10O3
SMILES
CCOC(=O)c1ccccc1O
Molecular Weight1
166.17
CAS
118-61-6
Other Names
  • 2-Hydroxybenzoic acid ethyl ester
  • Ethyl 2-hydroxybenzoate
  • Ethyl o-hydroxybenzoate
  • Ethyl salicylate
  • Mesotol
  • NSC 8209
  • Sal ethyl
  • Salicylic acid, ethyl ester
  • Salicylic ether
  • Salotan
  • o-(Ethoxycarbonyl)phenol
Sources

Physical Properties

Property Value Unit Source
Δf -251.23 kJ/mol Joback Calculated Property
Δfgas -414.67 kJ/mol Joback Calculated Property
Δfus 21.68 kJ/mol Joback Calculated Property
Δvap 60.07 kJ/mol Joback Calculated Property
logPoct/wat 1.57 Crippen Calculated Property
Pc 4130.29 kPa Joback Calculated Property
Tboil [495.50; 507.20] K Show Hide
Tboil 507.20 K NIST
Tboil 506.95 ± 0.50 K NIST
Tboil 495.50 ± 0.50 K NIST
Tboil 506.90 ± 1.00 K NIST
Tboil 504.65 ± 1.50 K NIST
Tc 816.64 K Joback Calculated Property
Tfus 401.49 K Joback Calculated Property
Vc 0.42 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 304.03 J/mol×K 588.91 Joback Calculated Property
η 0.00 Pa×s 588.91 Joback Calculated Property
ΔvapH 59.20 kJ/mol 310.5 NIST
ΔvapH 55.20 kJ/mol 419.5 NIST
ΔvapH 53.40 kJ/mol 446.0 NIST

Molecular Descriptors

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

Similar Compounds

Benzoic acid, 2-hydroxy-, 2-propenyl ester. 2-Hydroxyethyl salicylate. Benzoic acid, 2-hydroxy-, 1-methylethyl ester. Salicylic acid, n-propyl ester. Ethylene glycol, O-methyl-, O'-salicylate. Salicylic acid, tert.-butyl ester. 2-[(2-Hydroxybenzoyl)oxy]ethyl salicylate. Benzoic acid, 2-hydroxy-, methyl ester. Benzoic acid, 2-hydroxy-, 2-methylpropyl ester. Benzoic acid, 2-hydroxy-, 3-methyl-2-butenyl ester. Benzoic acid, 2-hydroxy-, butyl ester. Benzoic acid, 2-hydroxy-, pentyl ester. Ethylene glycol, O-acetyl-, O'-salicylate. Benzoic acid, 2-hydroxy-, 3-methylbutyl ester. cis-3-Hexenyl salicylate.

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