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3,4-Dichlorothiophene 1,1-Dioxide - >96.0%(GC), high purity , CAS No.52819-14-4

COA

Grade & Purity:

≥96%(GC)

Cas Number: 52819-14-4
Molecular Weight: 185.02
PubChem CID: 3040679

In stock

Item Number

D155853

Grouped product items
SKU	Size	Availability	Price	Qty
D155853-200mg	200mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$79.90
D155853-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$304.90

Discover 3,4-Dichlorothiophene 1,1-Dioxide by Aladdin Scientific in >96.0%(GC) for only $79.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3,4-Dichlorothiophene1,1-dioxide \| MFCD00187130 \| T71007 \| AKOS027325301 \| 327274TTBM \| 3,4-DICHLOROTHIOPHEN-1,1-DIOXIDE \| D3612 \| SCHEMBL2942319 \| Thiophene, 3,4-dichloro-, 1,1-dioxide \| BRN 1281864 \| DTXSID90200799 \| UNII-327274TTBM \| Q27256150 \| 3,4-Di
Specifications & Purity	≥96%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Thiophenes
    - Subclass Thiophene sulfoxides

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Thiophenes
Subclass	Thiophene sulfoxides
Intermediate Tree Nodes	Not available
Direct Parent	Thiophene sulfoxides
Alternative Parents	Sulfones Vinyl chlorides Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Thiophene sulfoxide - Sulfone - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as thiophene sulfoxides. These are organosulfur compounds containing a thiophene ring carrying a S=O bond (in some cases, a [S+][O-]).
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

Names and Identifiers

IUPAC Name	3,4-dichlorothiophene 1,1-dioxide
INCHI	InChI=1S/C4H2Cl2O2S/c5-3-1-9(7,8)2-4(3)6/h1-2H
InChIKey	CIDAIMONSYOOGS-UHFFFAOYSA-N
Smiles	C1=C(C(=CS1(=O)=O)Cl)Cl
Isomeric SMILES	C1=C(C(=CS1(=O)=O)Cl)Cl
RTECS	XM8650000
Molecular Weight	185.02
Reaxy-Rn	1281864
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1281864&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Melt Point(°C)	108 °C(dec.)
Molecular Weight	185.030 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	183.915 Da
Monoisotopic Mass	183.915 Da
Topological Polar Surface Area	42.500 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	256.000
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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