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2-Methoxy-4-nitrobenzenesulfonyl Chloride - >97.0%, high purity , CAS No.21320-91-2

COA

Grade & Purity:

≥97%

Cas Number: 21320-91-2
Molecular Weight: 251.64
MDL number: MFCD03094697
PubChem CID: 309458

In stock

Item Number

M158635

Grouped product items
SKU	Size	Availability	Price
M158635-200mg	200mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$10.90
M158635-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$38.90
M158635-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$113.90
M158635-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$508.90

View related series

Non heterocyclic block (8163) Sulfur containing compounds (986)

Basic Description

Synonyms	NSC 211731 \| 2-methoxy-4-nitrobenzenesulphonyl chloride \| Benzenesulfonyl chloride, 2-methoxy-4-nitro- \| J-013992 \| STL554184 \| 2-methoxy-4 nitrobenzenesulfonyl chloride \| 2-Methoxy-4-nitrobenzene-1-sulfonyl chloride \| AKOS005206969 \| FT-0638110 \| 2-Metho
Specifications & Purity	≥97%
Storage Temp	Argon charged
Shipped In	Normal
Product Description	2-Methoxy-4-nitrobenzenesulfonyl chloride [4-(chlorosulphonyl)-3-methoxynitrobenzene] may be used to synthesize 2-methoxy-4-nitro-N-o-tolyl-benzenesulfonamide.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Nitrobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Nitrophenyl ethers
Alternative Parents	Benzenesulfonyl chlorides Methoxyanilines Anisoles Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers Sulfonyls Sulfonyl chlorides Organosulfonic acids and derivatives Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organonitrogen compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrophenyl ether - Benzenesulfonyl chloride - Methoxyaniline - Benzenesulfonyl group - Anisole - Phenol ether - Methoxybenzene - Nitroaromatic compound - Phenoxy compound - Alkyl aryl ether - Sulfonyl halide - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Sulfonyl chloride - C-nitro compound - Organic nitro compound - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.
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-methoxy-4-nitrobenzenesulfonyl chloride
INCHI	InChI=1S/C7H6ClNO5S/c1-14-6-4-5(9(10)11)2-3-7(6)15(8,12)13/h2-4H,1H3
InChIKey	QECYXMKYZQXEHM-UHFFFAOYSA-N
Smiles	COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)Cl
Isomeric SMILES	COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)Cl
WGK Germany	3
Molecular Weight	251.64
Reaxy-Rn	2136023
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2136023&ln=

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

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Analytical Chart:

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2 results found

Lot Number	Certificate Type	Date	Item
L2425061	Certificate of Analysis	Dec 26, 2024	M158635
C2006154	Certificate of Analysis	Jan 27, 2022	M158635

Chemical and Physical Properties

Solubility	Soluble in Toluene
Sensitivity	Moisture sensitive.
Melt Point(°C)	90-95 °C
Molecular Weight	251.640 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	250.966 Da
Monoisotopic Mass	250.966 Da
Topological Polar Surface Area	97.600 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	332.000
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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