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(4-Cyanophenyl)methanesulfonyl chloride - 96%, high purity , CAS No.56105-99-8

COA

Grade & Purity:

≥96%

Cas Number: 56105-99-8
Molecular Weight: 215.7
PubChem CID: 15480555

In stock

Item Number

C185223

Grouped product items
SKU	Size	Availability	Price	Qty
C185223-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$185.90
C185223-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$770.90

Discover (4-Cyanophenyl)methanesulfonyl chloride by Aladdin Scientific in 96% for only $185.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	(4-cyanophenyl)methanesulfonyl chloride \| 56105-99-8 \| (4-Cyanophenyl)methanesulfonylchloride \| 4-Cyanobenzylsulfonyl chloride \| MFCD07690517 \| 4-cyanobenzylsulphonyl chloride \| SCHEMBL1500786 \| DTXSID20573165 \| UKKQISHRHXSEGI-UHFFFAOYSA-N \| GEO-03057 \| AKOS000118423 \| s10027 \|
Specifications & Purity	≥96%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzonitriles
Intermediate Tree Nodes	Not available
Direct Parent	Benzonitriles
Alternative Parents	Sulfonyls Sulfonyl chlorides Organosulfonic acids and derivatives Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzonitrile - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Sulfonyl halide - Sulfonyl chloride - Carbonitrile - Nitrile - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Cyanide - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
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	(4-cyanophenyl)methanesulfonyl chloride
INCHI	InChI=1S/C8H6ClNO2S/c9-13(11,12)6-8-3-1-7(5-10)2-4-8/h1-4H,6H2
InChIKey	UKKQISHRHXSEGI-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1CS(=O)(=O)Cl)C#N
Isomeric SMILES	C1=CC(=CC=C1CS(=O)(=O)Cl)C#N
Molecular Weight	215.7
Reaxy-Rn	3269769
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3269769&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	215.660 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	214.981 Da
Monoisotopic Mass	214.981 Da
Topological Polar Surface Area	66.300 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	303.000
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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