1,2,3,5-Tetrachlorobenzene - analytical standard , CAS No.634-90-2

CAS: 634-90-2 Cat. No.: T100479 Molecular Weight: 215.89 Beilstein Registry Number: 1618864 EC Number: 211-217-7 PubChem CID: 12468
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GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
1,2,3,5-TETRACHLOROBENZENE|634-90-2|Benzene, 1,2,3,5-tetrachloro-|I27N186CIN|DTXSID1026089|CHEBI:36696|NSC-78934|1,2,3,5-TETRACHLOROBENZENE-D2|2199-74-8|CCRIS 5936|HSDB 4269|EINECS 211-217-7|NSC 78934|BRN 1618864|UNII-I27N186CIN|AI3-18219|Benzene, 1,2,3,5
Storage
Room temperature
Shipped In
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Size
Status
Price
Qty
250mg
T100479-250mg
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Why this grade

analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
1, 2, 3, 5-TETRACHLOROBENZENE | 634-90-2 | Benzene, 1, 2, 3, 5-tetrachloro- | I27N186CIN | DTXSID1026089 | CHEBI:36696 | NSC-78934 | 1, 2, 3, 5-TETRACHLOROBENZENE-D2 | 2199-74-8 | CCRIS 5936 | HSDB 4269 | EINECS 211-217-7 | NSC 78934 | BRN 1618864 | UNII-I27N186CIN | AI3-18219 | Benzene, 1, 2, 3, 5
Specifications & Purity
analytical standard
Storage
Room temperature
Shipped In
FedEx DG Service
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Analytical standard
Names and Identifiers
Canonical SmilesC1=C(C=C(C(=C1Cl)Cl)Cl)Cl
IUPAC Name1,2,3,5-tetrachlorobenzene
InChIKeyQZYNWJQFTJXIRN-UHFFFAOYSA-N
INCHI1S/C6H2Cl4/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
Isomeric SMILES C1=C(C=C(C(=C1Cl)Cl)Cl)Cl
WGK Germany 3
RTECS DB9445000
PubChem CID 12468
Molecular Weight 215.89
Beilstein 1618864

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassHalobenzenes
Intermediate Tree Nodes Not available
Direct ParentChlorobenzenes
Alternative Parents Aryl chlorides  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Chlorobenzene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors tetrachlorobenzene
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
ESR1 Tclin Estrogen receptor alpha (17718 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot NumberCertificate TypeDateItem
C2310487Certificate of AnalysisDec 11, 2024 T100479
J2225700Certificate of AnalysisJul 03, 2024 T100479
J2016025Certificate of AnalysisAug 05, 2022 T100479
Chemical and Physical Properties
SensitivityMoisture sensitive.
Flash Point(°F)>112℃
Flash Point(°C)>112℃
Boil Point(°C)246°C
Melt Point(°C)51°C
Molecular Weight215.900 g/mol
XLogP34.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass215.888 Da
Monoisotopic Mass213.891 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count10
Formal Charge0
Complexity104.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
References
1. Yueyue Shen, Shilin Zhao, Yue Li, Qian Liu, Chongdi Ma, Hui Mao, Yang Liao, Jun Ma.  (2017)  A feasible approach to dispose of soil washing wastes: adsorptive removal of chlorobenzene compounds in aqueous solutions using humic acid modified with monoolein (HA–M).  RSC Advances,  (16): (9662-9668).  [PMID:] [10.1039/C6RA17949E]
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