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CHEBI:179164 - Chlorthal

ChEBI IDCHEBI:179164
ChEBI NameChlorthal
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SubmitterMetaboLights
DownloadsMolfile
FormulaC8H2Cl4O4
Net Charge0
Average Mass303.912
Monoisotopic Mass301.87072
SMILESO=C(O)c1c(Cl)c(Cl)c(C(=O)O)c(Cl)c1Cl
InChIInChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)
InChIKeyKZCBXHSWMMIEQU-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Chlorthal (CHEBI:179164) is a 2-hydroxyisophthalic acid (CHEBI:19643)
IUPAC Name 
2,3,5,6-tetrachloroterephthalic acid
Manual XrefsDatabases
HMDB0029628HMDB
15635ChemSpider
Registry NumbersSources
CAS:2136-79-0ChemIDplus