4-Chlorobenzoate

• Formula: C₇H₄ClO₂^-

• MW: 155.56

• SMILES String: [O-]C(=O)c1ccc(Cl)cc1

• Synonyms: chloradracylic; p-carboxychlorobenzene; p-Chlorobenzoic acid; PCBA

• CAS Reg. 74-11-3

• PubChem Substance Entry

• National Toxicology Program

• UM-BBD reactions whose product is 4-Chlorobenzoate
  • 4-Chlorobenzaldehyde -----> 4-Chlorobenzoate (reacID# r0447)
  • 2-Hydroxy-6-oxo-6-(4'-chlorophenyl)-hexa-2,4-dienoate -----> cis-2-Hydroxypenta-2,4-dienoate + 4-Chlorobenzoate (reacID# r0136)
  • 6-Oxo-2-hydroxy-7-(4'-chlorophenyl)-3,8,8,8-tetrachloroocta-2Z,4Z-dienoate -----> 4-Chlorobenzoate (reacID# r0453)

• UM-BBD reactions whose substrate is 4-Chlorobenzoate
  • 4-Chlorobenzoate -----> 4-Chlorobenzoyl-CoA (reacID# r0139)

Page Author(s): Shou-Lin Chang and Dong Jun Oh
August 14, 2006 Contact Us

This is the UM-BBD compound, compID# c0103.
It was generated on November 24, 2009 7:38:52 AM CST.

© 2009, University of Minnesota.