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5-Chloro-2-thiophenecarbonitrile - 97%, high purity , CAS No.50478-16-5

COA

Grade & Purity:

≥97%

Cas Number: 50478-16-5
Molecular Weight: 143.59
MDL number: MFCD09265032
PubChem CID: 12203265
PubChem SID: 488197938

In stock

Item Number

C170641

Grouped product items
SKU	Size	Availability	Price
C170641-1g	1g	3	$271.90
C170641-5g	5g	4	$1,222.90
C170641-25g	25g	2	$5,501.90

Discover 5-Chloro-2-thiophenecarbonitrile by Aladdin Scientific in 97% for only $271.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	MZALEEOEVCTDJA-UHFFFAOYSA-N \| MFCD09265032 \| EN300-65348 \| 2-Thiophenecarbonitrile, 5-chloro- \| 5-chloro-thiophene-2-carbonitrile \| 5-chlorothiophene-2-carbonitrile \| FT-0707827 \| DTXSID50480297 \| 5-Chloro-2-thiophenecarbonitrile \| SCHEMBL4963736 \| Z38135
Specifications & Purity	≥97%
Storage Temp	Room temperature,Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Thiophenes
    - Subclass 2,5-disubstituted thiophenes

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Thiophenes
Subclass	2,5-disubstituted thiophenes
Intermediate Tree Nodes	Not available
Direct Parent	2,5-disubstituted thiophenes
Alternative Parents	Aryl chlorides Heteroaromatic compounds Nitriles Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	2,5-disubstituted thiophene - Aryl halide - Aryl chloride - Heteroaromatic compound - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as 2,5-disubstituted thiophenes. These are organic compounds containing a thiophene that is disubstituted at the C-2, and C5-positions.
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

Pubchem Sid	488197938
IUPAC Name	5-chlorothiophene-2-carbonitrile
INCHI	InChI=1S/C5H2ClNS/c6-5-2-1-4(3-7)8-5/h1-2H
InChIKey	MZALEEOEVCTDJA-UHFFFAOYSA-N
Smiles	C1=C(SC(=C1)Cl)C#N
Isomeric SMILES	C1=C(SC(=C1)Cl)C#N
WGK Germany	3
Molecular Weight	143.59
Reaxy-Rn	111885
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=111885&ln=

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

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

Analytical Chart:

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4 results found

Lot Number	Certificate Type	Date	Item
B23071233	Certificate of Analysis	Dec 05, 2022	C170641
B23071214	Certificate of Analysis	Dec 05, 2022	C170641
C2518265	Certificate of Analysis	Dec 05, 2022	C170641
B23071262	Certificate of Analysis	Dec 05, 2022	C170641

Chemical and Physical Properties

Refractive Index	1.587
Flash Point(°F)	203 °F
Flash Point(°C)	95 °C
Boil Point(°C)	208 °C/760 mmHg
Molecular Weight	143.590 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	142.96 Da
Monoisotopic Mass	142.96 Da
Topological Polar Surface Area	52.000 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	128.000
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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