Bithionol sulfoxide  - ≥98% , CAS No.844-26-8

CAS: 844-26-8 Cat. No.: B694242 Numéro CE: 212-679-2 PubChem CID: 68939
DISPONIBLE À COMMANDE
GRADE & PURITY ≥98%
Storage
Room temperature
★
Size
Allemagne (EU)
USA*
Price
Qty
500mg
B694242-500mg
Sur commande · 8–12 semaines

766,13€

893,68€
Enregistrer 127,56 € (14.27%)
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships 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

Spécifications et pureté
≥98%
Conditions de stockage de stockage
Room temperature
Type d'action
INHIBITOR
Pureté
≥98%
Noms et identifiants
Sourires canoniques
C1=C(C=C(C(=C1S(=O)C2=C(C(=CC(=C2)Cl)Cl)O)O)Cl)Cl
IUPAC Name
2,4-dichloro-6-(3,5-dichloro-2-hydroxyphenyl)sulfinylphenol
InChIKey
RPAJWWXZIQJVJF-UHFFFAOYSA-N
INCHI
1S/C12H6Cl4O3S/c13-5-1-7(15)11(17)9(3-5)20(19)10-4-6(14)2-8(16)12(10)18/h1-4,17-18H
Isomères SMILES
C1=C(C=C(C(=C1S(=O)C2=C(C(=CC(=C2)Cl)Cl)O)O)Cl)Cl
CAS alternatif
844-26-8
PubChem CID
68939
Numéro NSC
523910
Termes d'entrée MeSH
bis(2-hydroxy-3,5-dichlorophenyl)sulfoxide;bis(3,5-dichloro-2-hydroxyphenyl)sulfoxide;bithionol sulfoxide;bithionol sulfoxide, monosodium salt;Bitin-S

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
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassPhenyl sulfoxides
Intermediate Tree Nodes Not available
Direct ParentPhenyl sulfoxides
Alternative Parents P-chlorophenols  O-chlorophenols  Dichlorobenzenes  Aryl chlorides  Sulfoxides  Sulfinyl compounds  Organooxygen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenyl sulfoxide - 1,3-dichlorobenzene - 4-chlorophenol - 4-halophenol - 2-halophenol - 2-chlorophenol - Chlorobenzene - Halobenzene - Phenol - Aryl chloride - Aryl halide - Sulfoxide - Sulfinyl compound - Organochloride - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenyl sulfoxides. These are organosulfur compounds containing a sulfoxide group substituted with a phenyl group.
External Descriptors Not available
Structure 3D
Modèle de structure chimique interactif





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Mécanismes d'action
Certificats (CoA, COO, BSE/TSE et tableau d'analyse)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriétés chimiques et physiques
Poids moléculaire372.000 g/mol
XLogP35.100
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass371.876 Da
Monoisotopic Mass369.879 Da
Topological Polar Surface Area76.700 Ų
Heavy Atom Count20
Formal Charge0
Complexity341.000
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
Calculateurs de solution
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