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CHEBI:164200 - triclosan

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ChEBI Name triclosan
ChEBI ID CHEBI:164200
Definition An aromatic ether that is phenol which is substituted at C-5 by a chloro group and at C-2 by a 2,4-dichlorophenoxy group. It is widely used as a preservative and antimicrobial agent in personal care products such as soaps, skin creams, toothpaste and deodorants as well as in household items such as plastic chopping boards, sports equipment and shoes.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:47700, CHEBI:29697
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Formula C12H7Cl3O2
Net Charge 0
Average Mass 289.54200
Monoisotopic Mass 287.951
InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
InChIKey XEFQLINVKFYRCS-UHFFFAOYSA-N
SMILES Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
Roles Classification
Biological Role(s): antibacterial agent
A substance that kills or slows the growth of bacteria.
fungicide
A substance used to destroy fungal pests.
Application(s): fungicide
A substance used to destroy fungal pests.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing triclosan (CHEBI:164200) has role antibacterial agent (CHEBI:33282)
triclosan (CHEBI:164200) has role fungicide (CHEBI:24127)
triclosan (CHEBI:164200) is a aromatic ether (CHEBI:35618)
triclosan (CHEBI:164200) is a dichlorobenzene (CHEBI:23697)
triclosan (CHEBI:164200) is a monochlorobenzenes (CHEBI:83403)
triclosan (CHEBI:164200) is a phenols (CHEBI:33853)
IUPAC Name
5-chloro-2-(2,4-dichlorophenoxy)phenol
INNs Sources
triclosan ChemIDplus
triclosan WHO MedNet
triclosán WHO MedNet
triclosanum ChemIDplus
Synonyms Sources
2,4,4'-Trichloro-2'-hydroxydiphenyl ether ChemIDplus
5-Chloro-2-(2,4-dichloro-phenoxy)-phenol ChEMBL
Triclosan KEGG COMPOUND
Database Links Databases
C12059 KEGG COMPOUND
D06226 KEGG DRUG
DB08604 DrugBank
LSM-2929 LINCS
NL6401526 Patent
TCL PDBeChem
Triclosan Wikipedia
US3506720 Patent
US3629477 Patent
View more database links
Registry Numbers Types Sources
2057142 Reaxys Registry Number Reaxys
2057142 Beilstein Registry Number Beilstein
3380-34-5 CAS Registry Number KEGG COMPOUND
3380-34-5 CAS Registry Number ChemIDplus
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Last Modified
25 February 2016