CHEBI:27715 - 3-chlorocatechol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-chlorocatechol
ChEBI ID CHEBI:27715
Definition A chlorocatechol that is catechol in which the hydrogen adjacent to one of the hydroxy groups is replaced by a chlorine.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1474, CHEBI:19986
Supplier Information
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Formula C6H5ClO2
Net Charge 0
Average Mass 144.55540
Monoisotopic Mass 143.99781
InChI InChI=1S/C6H5ClO2/c7-4-2-1-3-5(8)6(4)9/h1-3,8-9H
InChIKey GQKDZDYQXPOXEM-UHFFFAOYSA-N
SMILES Oc1cccc(Cl)c1O
ChEBI Ontology
Outgoing 3-chlorocatechol (CHEBI:27715) is a chlorocatechol (CHEBI:23138)
3-chlorocatechol (CHEBI:27715) is a monochlorobenzenes (CHEBI:83403)
IUPAC Name
3-chlorobenzene-1,2-diol
Synonyms Sources
3-Chlorocatechol KEGG COMPOUND
3-chlorocatechol UniProt
3-chloropyrocatechol ChemIDplus
Manual Xrefs Databases
c0144 UM-BBD
C05618 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1936442 Beilstein Registry Number Beilstein
4018-65-9 CAS Registry Number KEGG COMPOUND
4018-65-9 CAS Registry Number ChemIDplus
601665 Gmelin Registry Number Gmelin
Last Modified
30 November 2015