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N-(2-Fluorophenyl)methanesulfonamide , CAS No.98611-90-6

COA

Grade & Purity:

≥97%

Cas Number: 98611-90-6
Molecular Weight: 189.21
PubChem CID: 669015

In stock

Item Number

N350248

Grouped product items
SKU	Size	Availability	Price
N350248-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90
N350248-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$163.90
N350248-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$261.90

View related series

Fluorine containing blocks (199) Sulfonamide (8)

Basic Description

Synonyms	Z45639775 \| DTXSID50349936 \| N-(2-Fluorophenyl)methanesulfonamide,98 % \| N-(2-Fluorophenyl)methanesulfonamide \| N-(2-Fluorophenyl)methanesulfonamide, 98% \| CS-0223020 \| SCHEMBL6897963 \| EN300-113583 \| FT-0717965 \| V6I \| STK035732 \| AKOS000476878 \| DJLCKPR
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Sulfanilides
Intermediate Tree Nodes	Not available
Direct Parent	Sulfanilides
Alternative Parents	Fluorobenzenes Organosulfonamides Organic sulfonamides Aryl fluorides Aminosulfonyl compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Sulfanilide - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Organic sulfonic acid amide - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Organosulfonic acid or derivatives - Sulfonyl - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as sulfanilides. These are organic aromatic compounds containing a sulfanilide moiety, with the general structure RS(=O)(=O)NC1=CC=CC=C1.
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	N-(2-fluorophenyl)methanesulfonamide
INCHI	InChI=1S/C7H8FNO2S/c1-12(10,11)9-7-5-3-2-4-6(7)8/h2-5,9H,1H3
InChIKey	DJLCKPRURZWUOU-UHFFFAOYSA-N
Smiles	CS(=O)(=O)NC1=CC=CC=C1F
Isomeric SMILES	CS(=O)(=O)NC1=CC=CC=C1F
WGK Germany	3
Molecular Weight	189.21
Reaxy-Rn	4673384
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4673384&ln=

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

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6 results found

Lot Number	Certificate Type	Date	Item
A2517445	Certificate of Analysis	Jan 09, 2025	N350248
A2517449	Certificate of Analysis	Jan 09, 2025	N350248
A2517444	Certificate of Analysis	Jan 09, 2025	N350248
A2517442	Certificate of Analysis	Jan 09, 2025	N350248
A2517443	Certificate of Analysis	Jan 09, 2025	N350248
A2517448	Certificate of Analysis	Jan 09, 2025	N350248

Chemical and Physical Properties

Sensitivity	Moisture sensitive.
Melt Point(°C)	75-77 °C (lit.)
Molecular Weight	189.210 g/mol
XLogP3	1.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	189.026 Da
Monoisotopic Mass	189.026 Da
Topological Polar Surface Area	54.600 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	234.000
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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