2,3,6-Trichlorophenol - analytical standard , CAS No.933-75-5

CAS: 933-75-5 Cat. No.: T114094 Formula: C6H3Cl3O Molecular Weight: 197.45 Beilstein Registry Number: 1867596 EC Number: 213-271-7 PubChem CID: 13618
AVAILABLE TO ORDER
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
2,3,6-TRICHLOROPHENOL|933-75-5|Phenol, 2,3,6-trichloro-|AE2CMR564U|DTXSID5026209|2,3,6-TRICHLOROPHENOL-4,5-D2|DTXCID606209|HSDB 5773|93951-81-6|CAS-933-75-5|CCRIS 1937|Phenol, 2,3,6-trichloro-; 2,3,6-Trichlorophenol|EINECS 213-271-7|UNII-AE2CMR564U|BRN 18
Storage
Room temperature
Shipped In
Normal
★
Size
USA
Germany (EU)*
Price
Qty
250mg
T114094-250mg
1 In stock
—
$81.90
1g
T114094-1g
2 In stock
—
$169.90
Enter a quantity for the sizes you want to add.
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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 Normal 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.

📚

Literature proof

Cited in 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
2,3,6-TRICHLOROPHENOL | 933-75-5 | Phenol, 2,3,6-trichloro- | AE2CMR564U | DTXSID5026209 | 2,3,6-TRICHLOROPHENOL-4,5-D2 | DTXCID606209 | HSDB 5773 | 93951-81-6 | CAS-933-75-5 | CCRIS 1937 | Phenol, 2,3,6-trichloro-; 2,3,6-Trichlorophenol | EINECS 213-271-7 | UNII-AE2CMR564U | BRN 18
Specifications & Purity
analytical standard
Storage
Room temperature
Shipped In
Normal
Grade
Analytical standard
Names and Identifiers
Pubchem Sid
Canonical Smiles
C1=CC(=C(C(=C1Cl)O)Cl)Cl
IUPAC Name
2,3,6-trichlorophenol
InChIKey
XGCHAIDDPMFRLJ-UHFFFAOYSA-N
INCHI
1S/C6H3Cl3O/c7-3-1-2-4(8)6(10)5(3)9/h1-2,10H
Isomeric SMILES
C1=CC(=C(C(=C1Cl)O)Cl)Cl
WGK Germany
3
RTECS
SN1300000
PubChem CID
13618
UN Number
2020
Packing Group
III
Molecular Weight
197.45
Beilstein
1867596

Documentation

📋 Safety Data Sheet (SDS)

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

<<<<<<< HEAD Download SDS → ======= Download SDS → >>>>>>> release248-p3

✅ 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
ClassPhenols
SubclassHalophenols
Intermediate Tree Nodes Chlorophenols
Direct ParentO-chlorophenols
Alternative Parents M-chlorophenols  Chlorobenzenes  1-hydroxy-4-unsubstituted benzenoids  Aryl chlorides  Organooxygen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 2-chlorophenol - 3-chlorophenol - 1-hydroxy-4-unsubstituted benzenoid - Halobenzene - Chlorobenzene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as o-chlorophenols. These are chlorophenols carrying a iodine at the C2 position of the benzene ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AR Tclin Androgen Receptor (11781 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 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.

2 results found

Lot NumberCertificate TypeDateItem
G1812078G1812078Certificate of AnalysisJun 16, 2025 T114094
A2211150A2211150Certificate of AnalysisJun 11, 2025 T114094
Chemical and Physical Properties
Flash Point(°C)78℃
Boil Point(°C)88°C
Melt Point(°C)53-55°C
Molecular Weight197.400 g/mol
XLogP33.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass195.925 Da
Monoisotopic Mass195.925 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count10
Formal Charge0
Complexity120.000
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
Solution Calculators
Reviews

Customer Reviews

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