CHEBI:38855 - 3-chlorophenol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-chlorophenol
ChEBI ID CHEBI:38855
Definition A monochlorophenol carrying the chloro substituent at position 3.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:34330, CHEBI:49405, CHEBI:30397
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Formula C6H5ClO
Net Charge 0
Average Mass 128.55600
Monoisotopic Mass 128.00289
InChI InChI=1S/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H
InChIKey HORNXRXVQWOLPJ-UHFFFAOYSA-N
SMILES Oc1cccc(Cl)c1
ChEBI Ontology
Outgoing 3-chlorophenol (CHEBI:38855) is a monochlorophenol (CHEBI:38857)
IUPAC Name
3-chlorophenol
Synonyms Sources
3-CHLOROPHENOL PDBeChem
3-Chlorophenol KEGG COMPOUND
m-chlorophenol ChEBI
Manual Xrefs Databases
3CH PDBeChem
C14270 KEGG COMPOUND
CPD-10868 MetaCyc
DB01957 DrugBank
View more database links
Registry Numbers Types Sources
108-43-0 CAS Registry Number NIST Chemistry WebBook
108-43-0 CAS Registry Number ChemIDplus
1634401 Beilstein Registry Number Beilstein
1634401 Reaxys Registry Number Reaxys
2880 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
22939426 PubMed citation Europe PMC
23427611 PubMed citation Europe PMC
23479749 PubMed citation Europe PMC
Last Modified
18 February 2014