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2-(4-chlorophenyl)thioacetamide - 98%, high purity , CAS No.17518-48-8

COA

Grade & Purity:

≥98%

Cas Number: 17518-48-8
Molecular Weight: 185.7
PubChem CID: 2734827

In stock

Item Number

C182126

Grouped product items
SKU	Size	Availability	Price
C182126-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90
C182126-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$144.90
C182126-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$649.90

Discover 2-(4-chlorophenyl)thioacetamide by Aladdin Scientific in 98% for only $49.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-(4-chlorophenyl)ethanethioamide \| 17518-48-8 \| 2-(4-chlorophenyl)thioacetamide \| 2-(4-Chlorophenyl)-thioacetamide \| Benzeneethanethioamide, 4-chloro- \| MFCD00278249 \| Benzeneethanethioamide,4-chloro- \| Maybridge1_003392 \| 4-chlorophenyl(thioacetamide) \| SCHEMBL1999167 \| HM
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Halobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Halobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Chlorobenzenes
Alternative Parents	Aryl chlorides Thioamides Thiocarboxylic acid amides Thiocarbonyl compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Chlorobenzene - Aryl halide - Aryl chloride - Thioamide - Thiocarboxylic acid amide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Thiocarbonyl group - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
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	2-(4-chlorophenyl)ethanethioamide
INCHI	InChI=1S/C8H8ClNS/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H2,10,11)
InChIKey	QHCDYIRWTPEABF-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1CC(=S)N)Cl
Isomeric SMILES	C1=CC(=CC=C1CC(=S)N)Cl
Molecular Weight	185.7
Reaxy-Rn	2438720
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2438720&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	185.670 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	185.007 Da
Monoisotopic Mass	185.007 Da
Topological Polar Surface Area	58.100 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	141.000
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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