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Details

Stereochemistry ACHIRAL
Molecular Formula C6H3Cl3
Molecular Weight 181.447
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3,5-Trichlorobenzene

SMILES

ClC1=CC(Cl)=CC(Cl)=C1

InChI

InChIKey=XKEFYDZQGKAQCN-UHFFFAOYSA-N
InChI=1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H

HIDE SMILES / InChI

Molecular Formula C6H3Cl3
Molecular Weight 181.447
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Determination of organic priority pollutants in sewage treatment plant effluents by gas chromatography high-resolution mass spectrometry.
2010-09-15
Investigating roles of organic and inorganic soil components in sorption of polar and nonpolar aromatic compounds.
2010-01
Induction of hydroxyl radical production in Trametes versicolor to degrade recalcitrant chlorinated hydrocarbons.
2009-12
Phytotoxicity of chlorinated benzenes to Typha angustifolia and Phragmites communis.
2009-02
Role of biotransformation studies in minimizing metabolism-related liabilities in drug discovery.
2008
Aerobic degradation of di- and trichlorobenzenes by two bacteria isolated from polluted tropical soils.
2007-01
Sorption of organic pollutants by marine sediments: implication for the role of particulate organic matter.
2006-12
Characterization of aromatic compound sorptive interactions with black carbon (charcoal) assisted by graphite as a model.
2005-04-01
Photodegradation of 1,3,5-trichlorobenzene in aqueous surfactant solutions.
2005-02
Effect of additives on photodegradation of 1,3,5-trichlorobenzene in aqueous surfactant solutions.
2005
[Sorption and desorption of hydrophobic organic contaminants (HOCs) by different type of coal].
2004-11
Intercorrelations among degree of geochemical alterations, physicochemical properties, and organic sorption equilibria of kerogen.
2004-08-15
Importance of adsorption (hole-filling) mechanism for hydrophobic organic contaminants on an aquifer kerogen isolate.
2004-08-15
Dehalococcoides ethenogenes strain 195 reductively dechlorinates diverse chlorinated aromatic pollutants.
2004-04-01
Dehalorespiration with hexachlorobenzene and pentachlorobenzene by Dehalococcoides sp. strain CBDB1.
2003-12
Kerogen in aquifer material and its strong sorption for nonionic organic pollutants.
2003-10-11
Engineering substrate recognition in catalysis by cytochrome P450cam.
2003-06
Trace analysis of trichlorobenzenes in fish by microwave-assisted extraction and gas chromatography-electron-capture detection.
2003-04-18
Sorption and desorption hysteresis of organic contaminants by kerogen in a sandy aquifer material.
2003-03
Dehalogenation potential of municipal waste incineration fly ash. II. Comparison of dehalogenation pathways of fly ash and model fly ash with thermodynamic calculations.
2003
The role of condensed organic matter in the nonlinear sorption of hydrophobic organic contaminants by a peat and sediments.
2002-12-10
Crystal structure of the F87W/Y96F/V247L mutant of cytochrome P-450cam with 1,3,5-trichlorobenzene bound and further protein engineering for the oxidation of pentachlorobenzene and hexachlorobenzene.
2002-10-04
Dechlorination of chlorobenzenes by a culture containing bacterium DF-1, a PCB dechlorinating microorganism.
2002-08-01
Correlation of gas chromatographic properties of chlorobenzenes and polychlorinated biphenyls with the occurrence of reductive dechlorination by untamed microorganisms.
2001-10
Oxidation of polychlorinated benzenes by genetically engineered CYP101 (cytochrome P450(cam)).
2001-03
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:11:53 GMT 2025
Edited
by admin
on Mon Mar 31 19:11:53 GMT 2025
Record UNII
2HS4M0BX3C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-4389
Preferred Name English
1,3,5-Trichlorobenzene
HSDB   MI  
Systematic Name English
TRICHLOROBENZENE, 1,3,5-
Systematic Name English
SYMMETRICAL TRICHLOROBENZENE
Common Name English
SYM-TRICHLOROBENZENE
Common Name English
S-TRICHLOROBENZENE
Common Name English
BENZENE, 1,3,5-TRICHLORO-
Systematic Name English
1,3,5-TRICHLOROBENZENE [HSDB]
Common Name English
1,3,5-TRICHLOROBENZENE [MI]
Common Name English
Code System Code Type Description
CAS
108-70-3
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
PUBCHEM
7950
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
ECHA (EC/EINECS)
203-608-6
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
FDA UNII
2HS4M0BX3C
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
DRUG BANK
DB03836
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
MERCK INDEX
m11067
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID8026195
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
CHEBI
49916
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
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NSC
4389
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
HSDB
132
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
WIKIPEDIA
1,3,5-TRICHLOROBENZENE
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY
MESH
C500273
Created by admin on Mon Mar 31 19:11:53 GMT 2025 , Edited by admin on Mon Mar 31 19:11:53 GMT 2025
PRIMARY