Tetrachloro-o-benzoquinone - ≥95%(HPLC) , CAS No.2435-53-2

CAS: 2435-53-2 Cat. No.: T132896 Molecular Weight: 245.86 Beilstein Registry Number: 7602 EC Number: 219-424-4 PubChem CID: 73252
AVAILABLE TO ORDER
GRADE & PURITY ≥95%(HPLC)
Synonyms
3,4,5,6-Tetrachlorobenzo-1,2-quinone | o-Chloroanil | CHLORANIL, O- | trans-Cyclohexane-1,4-diol | 3,4,5,6-Tetrachloro-1,2-benzoquinone, 97% | D92426 | FT-0634277 | 3,2-dione, 3,4,5,6-tetrachloro- | InChI=1/C6Cl4O2/c7-1-2(8)4(10)6(12)5(11)3(1) | PD181082
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
T132896-1g
7
$59.90
5g
T132896-5g
1-2 wks(?)
Item is derived from our semi-finished stock and is processed in 1-2 weeks.
$199.90
25g
T132896-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$699.90
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Why this grade

≥95%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

Cited in 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
3, 4, 5, 6-Tetrachlorobenzo-1, 2-quinone | o-Chloroanil | CHLORANIL, O- | trans-Cyclohexane-1, 4-diol | 3, 4, 5, 6-Tetrachloro-1, 2-benzoquinone, 97% | D92426 | FT-0634277 | 3, 2-dione, 3, 4, 5, 6-tetrachloro- | InChI=1/C6Cl4O2/c7-1-2(8)4(10)6(12)5(11)3(1) | PD181082
Specifications & Purity
≥95%(HPLC)
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%(HPLC)
Names and Identifiers
Pubchem Sid488184771
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488184771
Canonical SmilesC1(=C(C(=O)C(=O)C(=C1Cl)Cl)Cl)Cl
IUPAC Name3,4,5,6-tetrachlorocyclohexa-3,5-diene-1,2-dione
InChIKeyVRGCYEIGVVTZCC-UHFFFAOYSA-N
INCHI1S/C6Cl4O2/c7-1-2(8)4(10)6(12)5(11)3(1)9
Isomeric SMILES C1(=C(C(=O)C(=O)C(=C1Cl)Cl)Cl)Cl
WGK Germany 3
PubChem CID 73252
Molecular Weight 245.86
Beilstein 7602
Reaxy-Rn 1309782

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.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Cyclic ketones - Quinones - Benzoquinones
Direct ParentO-benzoquinones
Alternative Parents Vinylogous halides  Alpha-chloroketones  Vinyl chlorides  Chloroalkenes  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents O-benzoquinone - Alpha-haloketone - Alpha-chloroketone - Vinylogous halide - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aliphatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as o-benzoquinones. These are benzoquinones where the two C=O groups are attached at the 1- and 2-positions, respectively.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
CES2 Tchem Cocaine esterase (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BCHE Tclin Butyrylcholinesterase (7174 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CES2 Tchem Carboxylesterase 2 (583 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CES1 Tchem Acyl coenzyme A:cholesterol acyltransferase (1029 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SNCA Tchem Alpha-synuclein (10960 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RAPGEF3 Tchem Rap guanine nucleotide exchange factor 3 (15528 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
WRN Tbio Werner syndrome ATP-dependent helicase (8824 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
ddn Putative uncharacterized protein (49 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.

6 results found

Lot NumberCertificate TypeDateItem
I2214310Certificate of AnalysisMar 11, 2026 T132896
E2310974Certificate of AnalysisFeb 07, 2025 T132896
E2310982Certificate of AnalysisFeb 07, 2025 T132896
E2310983Certificate of AnalysisFeb 07, 2025 T132896
E2310987Certificate of AnalysisFeb 07, 2025 T132896
I2214311Certificate of AnalysisJun 20, 2024 T132896
Chemical and Physical Properties
SolubilitySolubility in Methanol almost transparency
Melt Point(°C)126-129°C
Molecular Weight245.900 g/mol
XLogP32.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass245.862 Da
Monoisotopic Mass243.865 Da
Topological Polar Surface Area34.100 Ų
Heavy Atom Count12
Formal Charge0
Complexity305.000
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. Jingyao Wang, Jingqiu Jiang, Hongxia Zhao, Zhansheng Li, Xintong Li, Shafiul Azam, Baocheng Qu.  (2024)  Phototransformation of halobenzoquinones in aqueous solution under the simulate sunlight: Kinetics, mechanism and products.  CHEMOSPHERE,      [PMID:38311038] [10.1016/j.chemosphere.2024.141318]
2. Siyu Chen, Xuanzhi Dong, Yanhua Yong, Yang Liu, Jun Luo, Jingqiu Jiang, Hongxia Zhao, Baocheng Qu, Siyu Liu.  (2025)  Occurrence and formation of halobenzoquinones in seawater of Dalian Aquarium, China.  MARINE ENVIRONMENTAL RESEARCH,      [PMID:41223693] [10.1016/j.marenvres.2025.107700]
Solution Calculators
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