(4-Chlorophenylsulfonyl)acetone - ≥98% , CAS No.5000-48-6

CAS: 5000-48-6 Cat. No.: C170616 Formula: C9H9ClO3S Peso molecolare: 232.68 Numero EC: 672-265-6
Disponibile su ordine
GRADE & PURITY ≥98%
Synonyms
1-(4-chlorophenyl)sulfonyl-2-propanone | 4-Chlorophenylsulfonylacetone | HMS554M21 | SCHEMBL2027971 | SR-01000641165-1 | 4-Chlorobenzenesulfonylacetone | 4-Chlorobenzenesulphonyl acetone | MS-7143 | A827928 | KM 01166 | Propan-2-one, 1-(4-chlorophenylsulp
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
★
Size
Germania (EU)
USA*
Price
Qty
250mg
C170616-250mg
Su ordinazione · 8–12 settimane
43,30€
1g
C170616-1g
Su ordinazione · 8–12 settimane
104,04€
5g
C170616-5g
Su ordinazione · 8–12 settimane
373,04€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

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

Specifications

Sinonimi
1-(4-chlorophenyl)sulfonyl-2-propanone | 4-Chlorophenylsulfonylacetone | HMS554M21 | SCHEMBL2027971 | SR-01000641165-1 | 4-Chlorobenzenesulfonylacetone | 4-Chlorobenzenesulphonyl acetone | MS-7143 | A827928 | KM 01166 | Propan-2-one, 1-(4-chlorophenylsulp
Specifiche e purezza
≥98%
Condizioni di conservazione di stoccaggio
Store at 2-8°C,Argon charged
Spedito in
Wet ice
Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.
Purezza
≥98%
Nomi e identificatori
Sorrisi canonici
CC(=O)CS(=O)(=O)C1=CC=C(C=C1)Cl
IUPAC Name
1-(4-chlorophenyl)sulfonylpropan-2-one
InChIKey
BRDBHPZILGTBFY-UHFFFAOYSA-N
INCHI
1S/C9H9ClO3S/c1-7(11)6-14(12,13)9-4-2-8(10)3-5-9/h2-5H,6H2,1H3
Isomeri SMILES
CC(=O)CS(=O)(=O)C1=CC=C(C=C1)Cl
Peso molecolare
232.68
Reaxy-Rn
2051464
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2051464&ln=

Documentazione

📋 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
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassBenzenesulfonyl compounds
Intermediate Tree Nodes Not available
Direct ParentBenzenesulfonyl compounds
Alternative Parents Chlorobenzenes  Aryl chlorides  Sulfones  Ketones  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Benzenesulfonyl group - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Sulfonyl - Sulfone - Ketone - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organosulfur compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Certificati (CoA, COO, BSE/TSE e tabella di analisi)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Proprietà chimiche e fisiche
SensibilitàMoisture sensitive
Punto di fusione (°C)78-82°C
Peso molecolare232.680 g/mol
XLogP31.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass231.996 Da
Monoisotopic Mass231.996 Da
Topological Polar Surface Area59.600 Ų
Heavy Atom Count14
Formal Charge0
Complexity297.000
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
Calcolatori di soluzioni
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