CHEBI:34688 - dichloroacetyl chloride

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ChEBI Name dichloroacetyl chloride
ChEBI ID CHEBI:34688
Definition The acyl chloride obtained by displacement of the hydroxy group of dichloroacetic acid by chloride.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C2HCl3O
Net Charge 0
Average Mass 147.38800
Monoisotopic Mass 145.909
InChI InChI=1S/C2HCl3O/c3-1(4)2(5)6/h1H
InChIKey FBCCMZVIWNDFMO-UHFFFAOYSA-N
SMILES ClC(Cl)C(Cl)=O
Roles Classification
Biological Role(s): hapten
Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
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ChEBI Ontology
Outgoing dichloroacetyl chloride (CHEBI:34688) has functional parent dichloroacetic acid (CHEBI:36386)
dichloroacetyl chloride (CHEBI:34688) has role hapten (CHEBI:59174)
dichloroacetyl chloride (CHEBI:34688) is a acyl chloride (CHEBI:36687)
IUPAC Name
dichloroacetyl chloride
Synonyms Sources
2,2-Dichloroacetyl chloride ChemIDplus
α,α-dichloroacetyl chloride ChemIDplus
CHCl2COCl NIST Chemistry WebBook
Chlorure de dichloracetyle ChemIDplus
Dichloracetyl chloride ChemIDplus
Dichloroacetic acid chloride NIST Chemistry WebBook
Dichloroethanoyl chloride ChemIDplus
Manual Xref Database
C14867 KEGG COMPOUND
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Registry Numbers Types Sources
1209426 Beilstein Registry Number Beilstein
430743 Gmelin Registry Number Gmelin
79-36-7 CAS Registry Number NIST Chemistry WebBook
79-36-7 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
9130009 PubMed citation Europe PMC
Last Modified
13 October 2010