Pentachlorothioanisole - analytical standard , CAS No.1825-19-0

CAS: 1825-19-0 Cat. No.: P135776 Summenformel: C7H3Cl5S Molekulargewicht: 296.41 EG-Nummer: 217-363-8 PubChem CID: 15766
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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
J-011679 | BRN 2214412 | InChI=1/C7H3Cl5S/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3 | 1,2,3,5,6-Pentachloro-4-(methylthio)benzene | Methyl-pentachlorophenylsulfide | NCGC00248177-01 | Pctas | T71975 | BAA82519 | P1067 | LGZZJTIUEJNNKV-UHFFFAOYSA- | CAS-1825-1
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
100mg
P135776-100mg
Auf Bestellung · 8–12 Wochen

138,75€

161,31€
Speichern 22,56 € (13.99%)
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Why this grade

analytical standard Analytischer 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.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
J-011679 | BRN 2214412 | InChI=1/C7H3Cl5S/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3 | 1,2,3,5,6-Pentachloro-4-(methylthio)benzene | Methyl-pentachlorophenylsulfide | NCGC00248177-01 | Pctas | T71975 | BAA82519 | P1067 | LGZZJTIUEJNNKV-UHFFFAOYSA- | CAS-1825-1
Spezifikationen & Reinheit
analytical standard
Storage
Room temperature
Verschickt in
Normal
Note
Analytischer Standard
Namen und Kennungen
Kanonisches LächelnCSC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl
IUPAC Name1,2,3,4,5-pentachloro-6-methylsulfanylbenzene
InChIKeyLGZZJTIUEJNNKV-UHFFFAOYSA-N
INCHI1S/C7H3Cl5S/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
Isomere SMILES CSC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl
RTECS WQ5520000
PubChem CID 15766
Molekulargewicht 296.41
Reaxy-Rn 2214412

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
SuperclassOrganosulfur compounds
KlasseThioethers
SubclassAryl thioethers
Intermediate Tree Nodes Not available
Direct ParentAryl thioethers
Alternative Parents Thiophenol ethers  Chlorobenzenes  Alkylarylthioethers  Aryl chlorides  Sulfenyl compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aryl thioether - Thiophenol ether - Alkylarylthioether - Halobenzene - Chlorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Sulfenyl compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemische und physikalische Eigenschaften
Schmelzpunkt (°C)95 °C
Molekulargewicht296.400 g/mol
XLogP35.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass295.837 Da
Monoisotopic Mass293.84 Da
Topological Polar Surface Area25.300 Ų
Heavy Atom Count13
Formal Charge0
Complexity162.000
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
Lösungsrechner
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Häufig gestellte Fragen

How is this product shipped?
This product ships under standard ambient conditions. No temperature-controlled packaging is required.
What does analytical standard mean?
analytical standard is a defined analytical purity tier suitable for quantitative analytical methods. It specifies a minimum assay percentage, controlled limits on common impurities (water, heavy metals, residue on ignition), and lot-to-lot consistency. analytical standard is one of several purity tiers — choose based on the sensitivity and regulatory requirements of your method.
How should this product be stored?
Store at room temperature.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 1825-19-0, the molecular formula is C7H3Cl5S, and the molecular weight is 296.41 g/mol. InChIKey LGZZJTIUEJNNKV-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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