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2,4-Dimethoxybenzoyl chloride - 96%, high purity , CAS No.39828-35-8

COA

Grade & Purity:

≥96%

Cas Number: 39828-35-8
Molecular Weight: 200.62
MDL number: MFCD00017527
PubChem CID: 2734719

In stock

Item Number

D122560

Grouped product items
SKU	Size	Availability	Price
D122560-1g	1g	3	$27.90
D122560-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$78.90
D122560-25g	25g	1	$354.90
D122560-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,277.90

Basic Description

Synonyms	SCHEMBL220681 \| 9N-827 \| KVIUXRJCBBXEGJ-UHFFFAOYSA-N \| 2,4-dimethoxy-1-benzenecarbonyl chloride \| 2,4-Dimethoxybenzoyl chloride, technical grade \| MFCD00017527 \| 2,4-dimethoxy benzoyl chloride \| SY358279 \| AKOS009159129 \| E85442 \| FT-0639581 \| DTXSID50370
Specifications & Purity	≥96%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	2,4-Dimethoxybenzoyl chloride is a benzoyl chloride derivative 2,4-Dimethoxybenzoyl chloride may be used as starting reagent in the synthesis of coumestrol. It may be used in the synthesis of chromenoflavone, cycloartocarpesin trimethyl ether.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Methoxybenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Dimethoxybenzenes
Alternative Parents	Benzoic acids and derivatives Phenoxy compounds Benzoyl derivatives Anisoles Alkyl aryl ethers Acyl chlorides Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	M-dimethoxybenzene - Dimethoxybenzene - Benzoic acid or derivatives - Phenoxy compound - Phenol ether - Anisole - Benzoyl - Alkyl aryl ether - Acyl chloride - Acyl halide - Ether - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
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-dimethoxybenzoyl chloride
INCHI	InChI=1S/C9H9ClO3/c1-12-6-3-4-7(9(10)11)8(5-6)13-2/h3-5H,1-2H3
InChIKey	KVIUXRJCBBXEGJ-UHFFFAOYSA-N
Smiles	COC1=CC(=C(C=C1)C(=O)Cl)OC
Isomeric SMILES	COC1=CC(=C(C=C1)C(=O)Cl)OC
WGK Germany	3
UN Number	3261
Molecular Weight	200.62
Reaxy-Rn	2415461
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2415461&ln=

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
B2517315	Certificate of Analysis	Feb 18, 2025	D122560
K2204146	Certificate of Analysis	Mar 13, 2023	D122560
K2204148	Certificate of Analysis	Mar 13, 2023	D122560
K2204147	Certificate of Analysis	Mar 13, 2023	D122560
B2429015	Certificate of Analysis	Mar 13, 2023	D122560
K2204145	Certificate of Analysis	Mar 13, 2023	D122560

Chemical and Physical Properties

Sensitivity	Moisture Sensitive
Melt Point(°C)	58-60°C
Molecular Weight	200.620 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	200.024 Da
Monoisotopic Mass	200.024 Da
Topological Polar Surface Area	35.500 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	184.000
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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