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Thianthrene 5-oxide - 97%, high purity , CAS No.2362-50-7

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Thianthrene 5-oxide - 97%, high purity , CAS No.2362-50-7

COA

Grade & Purity:

≥97%

Cas Number: 2362-50-7
Molecular Weight: 232.32
EC Number: ‘851-277-7
PubChem CID: 73220

In stock

Item Number

T588320

Grouped product items
SKU	Size	Availability	Price
T588320-100mg	100mg	3	$40.90
T588320-250mg	250mg	3	$82.90
T588320-1g	1g	3	$127.90
T588320-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$491.90

Basic Description

Synonyms	BS-16583 \| NSC 16859 \| thianthren 5-oxid \| SCHEMBL1144620 \| AE-562/12222893 \| Thianthrene 5-oxide \| NSC16859 \| AKOS037649108 \| DTXSID00178293 \| E?-thianthren-5-one \| Thianthrene monooxide \| TCMDC-124300 \| thianthrene-S-oxide \| SMR001547988 \| C12H8OS2 \| D8
Specifications & Purity	≥97%
Storage Temp	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.
Product Description	Product Application: Thianthrene S-oxide is a sulfoxide-based thianthrene reagent for late-stage C-H functionalization.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzodithiins
    - Subclass 1,4-benzodithiins

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzodithiins
Subclass	1,4-benzodithiins
Intermediate Tree Nodes	Not available
Direct Parent	Thianthrenes
Alternative Parents	Diarylthioethers Benzenoids Sulfoxides Sulfinyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Thianthrene - Diarylthioether - Aryl thioether - Benzenoid - Sulfoxide - Sulfinyl compound - Thioether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as thianthrenes. These are organic compounds containing a thianthrene moiety. Thianthrene is a tricyclic ring system that consists of two benzene rings fused to each other through a 1,4-dithiin ring.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

SLC2A1 Tchem Glucose transporter (14755 Activities)

Discover Target: SLC2A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HepG2 (196354 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Plasmodium falciparum (966862 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ht1 Hexose transporter 1 (14071 Activities)

Discover Target: ht1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	thianthrene 5-oxide
INCHI	InChI=1S/C12H8OS2/c13-15-11-7-3-1-5-9(11)14-10-6-2-4-8-12(10)15/h1-8H
InChIKey	NYVGTLXTOJKHJN-UHFFFAOYSA-N
Smiles	C1=CC=C2C(=C1)SC3=CC=CC=C3S2=O
Isomeric SMILES	C1=CC=C2C(=C1)SC3=CC=CC=C3S2=O
PubChem CID	73220
NSC Number	NSC Number': ['16859
Molecular Weight	232.32

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.

4 results found

Lot Number	Certificate Type	Date	Item
G23261325	Certificate of Analysis	Jul 06, 2023	T588320
G23261328	Certificate of Analysis	Jul 06, 2023	T588320
G23261315	Certificate of Analysis	Jul 06, 2023	T588320
G23261320	Certificate of Analysis	Jul 06, 2023	T588320

Chemical and Physical Properties

Sensitivity	Air sensitive; Heat sensitive
Melt Point(°C)	144 °C
Molecular Weight	232.300 g/mol
XLogP3	2.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	232.002 Da
Monoisotopic Mass	232.002 Da
Topological Polar Surface Area	73.600 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	242.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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