Chemical Properties of 5-Bromosalicylic acid (CAS 89-55-4)

5-Bromosalicylic acid

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InChI
InChI=1S/C7H5BrO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,(H,10,11)
InChI Key
IEJOONSLOGAXNO-UHFFFAOYSA-N
Formula
C7H5BrO3
SMILES
O=C(O)c1cc(Br)ccc1O
Molecular Weight1
217.02
CAS
89-55-4
Other Names
  • 2-Hydroxy-5-bromobenzoic acid
  • 5-Bromo-2-hydroxybenzoic acid
  • 5-Bromosalicylic acid
  • Benzoic acid, 3-bromo-6-hydroxy-
  • Salicylic acid, 5-bromo-
Sources

Physical Properties

Property Value Unit Source
Δf -295.20 kJ/mol Joback Calculated Property
Δfgas -378.54 kJ/mol Joback Calculated Property
Δfus 24.29 kJ/mol Joback Calculated Property
Δvap 76.99 kJ/mol Joback Calculated Property
logPoct/wat 1.85 Crippen Calculated Property
Pc 6932.88 kPa Joback Calculated Property
Tboil 684.05 K Joback Calculated Property
Tc 916.63 K Joback Calculated Property
Tfus 489.86 K Joback Calculated Property
Vc 0.37 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 255.56 J/mol×K 684.05 Joback Calculated Property
η 0.00 Pa×s 684.05 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 3
-OH (alcohol) 1
=C< (ring) 3
>C=O (nonring) 1
-OH (phenol) 1
-Br 1

Similar Compounds

3-Bromo-2-hydroxybenzoic acid. 3,5-Dibromo-2-hydroxybenzoic acid. 5-Bromo-2,4-dihydroxybenzoic acid. 5-Bromo-2-hydroxybenzaldehyde. Benzoic acid, 2-hydroxy-. 2-(Acetyloxy)-5-bromobenzoic acid. Benzoic acid, 2,6-dihydroxy-. Benzoic acid, 3-bromo-. 2-Hydroxy-4-methylbenzoic acid. Benzoic acid, 2-hydroxy-, methyl ester. gentisic acid. Hydroxytoluic acid. 3,5-Dibromo-4-hydroxybenzoic acid. 2,4-Dihydroxybenzoic acid. 5-Methylsalicylic acid.

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