Chemical Properties of Benzoic acid, 2-hydroxy-, butyl ester (CAS 2052-14-4)

Benzoic acid, 2-hydroxy-, butyl ester

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InChI
InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7,12H,2-3,8H2,1H3
InChI Key
YFDUWSBGVPBWKF-UHFFFAOYSA-N
Formula
C11H14O3
SMILES
CCCCOC(=O)c1ccccc1O
Molecular Weight1
194.23
CAS
2052-14-4
Other Names
  • 2-Hydroxy-benzoic acid, butyl ester
  • Butyl 2-hydroxybenzoate
  • Butyl o-hydroxybenzoate
  • Butyl salicylate
  • NSC 1511
  • NSC 403676
  • Salicylic acid, butyl ester
  • Salicylic acid, n-butyl ester
  • n-Butyl o-hydroxybenzoate
  • n-Butyl salicylate
Sources

Physical Properties

Property Value Unit Source
Δf -234.39 kJ/mol Joback Calculated Property
Δfgas -455.95 kJ/mol Joback Calculated Property
Δfus 26.86 kJ/mol Joback Calculated Property
Δvap 64.53 kJ/mol Joback Calculated Property
logPoct/wat 2.349 Crippen Calculated Property
Pc 3272.78 kPa Joback Calculated Property
Tboil 544.20 K NIST
Tc 854.09 K Joback Calculated Property
Tfus 424.03 K Joback Calculated Property
Vc 0.533 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 398.53 J/mol×K 634.67 Joback Calculated Property
η 0.0000257 Pa×s 634.67 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Benzoic acid, 2-hydroxy-, pentyl ester. Benzoic acid, 2-hydroxy-, 3-methylbutyl ester. N-hexyl salicylate. Salicylic acid, n-propyl ester. Benzoic acid, 2-hydroxy-, heptyl ester. Salicylic acid, n-octyl ester. Benzoic acid, 2-hydroxy-, 2-methylbutyl ester. Benzoic acid, 2-hydroxy-, 2-methylpropyl ester. Salicylic acid, 1-methylpropyl ester. Benzoic acid, 2-hydroxy-, ethyl ester. cis-3-Hexenyl salicylate. (E)-Hex-3-enyl salicylate. 2-Ethylhexyl salicylate. Benzoic acid, 2-hydroxy-, 1-methylethyl ester. Benzoic acid, 2-hydroxy-, 2-propenyl ester.

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