3-(Trifluoromethoxy)benzenesulfonyl chloride - ≥97% , CAS No.220227-84-9

CAS: 220227-84-9 Cat. No.: T168683 Molecular Weight: 260.62 EC Number: 624-326-3 PubChem CID: 2777218
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
MFCD01091016 | 3-(Trifluoromethoxy)benzenesulfonyl chloride | 3-(trifluoromethoxy)-benzenesulfonyl chloride | A815840 | PS-10853 | 3-(Trifluoromethoxy)phenylsulfonyl chloride | 3-[(trifluoromethyl)oxy]benzenesulfonyl chloride | BBL100503 | SCHEMBL442910 |
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
T168683-250mg
3

$9.90

$14.90
Save $5.00 (33.56%)
1g
T168683-1g
5

$13.90

$20.90
Save $7.00 (33.49%)
5g
T168683-5g
1

$32.90

$49.90
Save $17.00 (34.07%)
25g
T168683-25g
2

$55.90

$83.90
Save $28.00 (33.37%)
100g
T168683-100g
1

$179.90

$269.90
Save $90.00 (33.35%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
MFCD01091016 | 3-(Trifluoromethoxy)benzenesulfonyl chloride | 3-(trifluoromethoxy)-benzenesulfonyl chloride | A815840 | PS-10853 | 3-(Trifluoromethoxy)phenylsulfonyl chloride | 3-[(trifluoromethyl)oxy]benzenesulfonyl chloride | BBL100503 | SCHEMBL442910 |
Specifications & Purity
≥97%
Storage
Store at 2-8°C, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥97%
Names and Identifiers
Canonical SmilesC1=CC(=CC(=C1)S(=O)(=O)Cl)OC(F)(F)F
IUPAC Name3-(trifluoromethoxy)benzenesulfonyl chloride
InChIKeyDODDSXTWDSJCDN-UHFFFAOYSA-N
INCHI1S/C7H4ClF3O3S/c8-15(12,13)6-3-1-2-5(4-6)14-7(9,10)11/h1-4H
Isomeric SMILES C1=CC(=CC(=C1)S(=O)(=O)Cl)OC(F)(F)F
WGK Germany 3
PubChem CID 2777218
Molecular Weight 260.62

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.

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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
SubclassBenzenesulfonyl compounds
Intermediate Tree Nodes Benzenesulfonyl halides
Direct ParentBenzenesulfonyl chlorides
Alternative Parents Phenoxy compounds  Phenol ethers  Sulfonyls  Sulfonyl chlorides  Organosulfonic acids and derivatives  Trihalomethanes  Organooxygen compounds  Organofluorides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Benzenesulfonyl chloride - Phenoxy compound - Phenol ether - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl chloride - Sulfonyl halide - Sulfonyl - Trihalomethane - Halomethane - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organofluoride - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzenesulfonyl chlorides. These are aromatic compounds containing a benzenesulfonyl group, where the sulfonyl moiety is singly boned to a chloride atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





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
I2328116Certificate of AnalysisJul 23, 2025 T168683
I2328171Certificate of AnalysisJul 23, 2025 T168683
I2328172Certificate of AnalysisJul 23, 2025 T168683
I2328173Certificate of AnalysisJul 23, 2025 T168683
I2328572Certificate of AnalysisJul 23, 2025 T168683
L2209313Certificate of AnalysisDec 28, 2022 T168683
Chemical and Physical Properties
SensitivityMoisture Sensitive
Refractive Index1.48
Flash Point(°F)>230 °F
Flash Point(°C)>110 °C
Boil Point(°C)230 °C
Molecular Weight260.620 g/mol
XLogP32.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass259.952 Da
Monoisotopic Mass259.952 Da
Topological Polar Surface Area51.800 Ų
Heavy Atom Count15
Formal Charge0
Complexity308.000
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
Solution Calculators
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