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CHEBI:82274 - (trichloromethyl)benzene

ChEBI IDCHEBI:82274
ChEBI Name(trichloromethyl)benzene
Stars
DefinitionAn organochlorine compound that is toluene in which all three hydrogens of the methyl group have been replaced by chlorines. It is used as an intermediate in organic synthesis and dye chemistry.
Last Modified15 March 2018
DownloadsMolfile
FormulaC7H5Cl3
Net Charge0
Average Mass195.476
Monoisotopic Mass193.94568
SMILESClC(Cl)(Cl)c1ccccc1
InChIInChI=1S/C7H5Cl3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H
InChIKeyXEMRAKSQROQPBR-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
carcinogenic agent  A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
ChEBI Ontology
Outgoing Relation(s)
(trichloromethyl)benzene (CHEBI:82274) has role carcinogenic agent (CHEBI:50903)
(trichloromethyl)benzene (CHEBI:82274) is a benzenes (CHEBI:22712)
(trichloromethyl)benzene (CHEBI:82274) is a organochlorine compound (CHEBI:36683)
(trichloromethyl)benzene (CHEBI:82274) is a volatile organic compound (CHEBI:134179)
IUPAC Name 
(trichloromethyl)benzene
Synonyms  Source
benzotrichlorideChemIDplus
1-(trichloromethyl)benzeneChemIDplus
α,α,α-trichlorotolueneChemIDplus
phenylchloroformChemIDplus
Manual XrefsDatabases
C19166KEGG COMPOUND
US1828858Patent
BenzotrichlorideWikipedia
Registry NumbersSources
CAS:98-07-7KEGG COMPOUND
CAS:98-07-7ChemIDplus
CAS:98-07-7NIST Chemistry WebBook
Citations