CHEBI:27544 - 3,5-dibromo-4-hydroxybenzoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3,5-dibromo-4-hydroxybenzoate
ChEBI ID CHEBI:27544
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11705, CHEBI:19897
Supplier Information
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Formula C7H3Br2O3
Net Charge -1
Average Mass 294.90492
Monoisotopic Mass 292.84544
InChI InChI=1S/C7H4Br2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)/p-1
InChIKey PHWAJJWKNLWZGJ-UHFFFAOYSA-M
SMILES Oc1c(Br)cc(cc1Br)C([O-])=O
ChEBI Ontology
Outgoing 3,5-dibromo-4-hydroxybenzoate (CHEBI:27544) has functional parent 2,6-dibromophenol (CHEBI:19391)
3,5-dibromo-4-hydroxybenzoate (CHEBI:27544) has functional parent benzoate (CHEBI:16150)
3,5-dibromo-4-hydroxybenzoate (CHEBI:27544) is a monohydroxybenzoate (CHEBI:25388)
3,5-dibromo-4-hydroxybenzoate (CHEBI:27544) is conjugate base of 3,5-dibromo-4-hydroxybenzoic acid (CHEBI:1395)
Incoming 3,5-dibromo-4-hydroxybenzoic acid (CHEBI:1395) is conjugate acid of 3,5-dibromo-4-hydroxybenzoate (CHEBI:27544)
IUPAC Name
3,5-dibromo-4-hydroxybenzoate
Manual Xref Database
c0509 UM-BBD
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Registry Number Type Source
3337-62-0 CAS Registry Number UM-BBD
Last Modified
15 January 2019