Chemical Properties of 2-Amino-5-bromobenzoic acid (CAS 5794-88-7)

2-Amino-5-bromobenzoic acid

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InChI
InChI=1S/C7H6BrNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,11)
InChI Key
CUKXRHLWPSBCTI-UHFFFAOYSA-N
Formula
C7H6BrNO2
SMILES
Nc1ccc(Br)cc1C(=O)O
Molecular Weight1
216.03
CAS
5794-88-7
Other Names
  • 5-Bromo-2-aminobenzoic acid
  • 5-Bromoanthranilic acid
  • Anthranilic acid, 5-bromo-
  • Benzoic acid, 2-amino-5-bromo-
Sources

Physical Properties

Property Value Unit Source
Δf -83.76 kJ/mol Joback Calculated Property
Δfgas -178.91 kJ/mol Joback Calculated Property
Δfus 23.32 kJ/mol Joback Calculated Property
Δvap 75.28 kJ/mol Joback Calculated Property
logPoct/wat 1.73 Crippen Calculated Property
Pc 5845.00 kPa Joback Calculated Property
Tboil 680.94 K Joback Calculated Property
Tc 912.27 K Joback Calculated Property
Tfus 473.92 K Joback Calculated Property
Vc 0.44 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 264.54 J/mol×K 680.94 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 3
-OH (alcohol) 1
-NH2 1
=C< (ring) 3
>C=O (nonring) 1
-Br 1

Similar Compounds

3,5-Dibromoanthranilic acid. Anthranilic acid. 2-Acetamino-5-bromobenzoic acid. Benzoic acid, 3-bromo-. 3,5-Dibromobenzoic acid. P-toluic acid, 2-amino-. Benzoic acid, 2-amino-, methyl ester. Benzoic acid, 3-bromo-, methyl ester. 2-Amino-5-methylbenzoic acid. Benzoic acid, 2-amino-, ethyl ester. Methyl 3,5-dibromobenzoate. 2-Amino-3-methylbenzoic acid. N-methylanthranilic acid. 2-Amino-4-chlorobenzoic acid. Anthranilic acid, isopropyl ester.

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