Cas no 64507-09-1 (Benzoyl chloride,2-ethoxy-5-methyl-)

2-Ethoxy-5-methylbenzoyl chloride is a specialized organic compound featuring both benzoyl chloride and ethoxy-methyl substituents. This reagent is particularly valuable in synthetic organic chemistry, where it serves as an acylating agent for introducing the 2-ethoxy-5-methylbenzoyl moiety into target molecules. Its electron-rich aromatic ring and reactive acyl chloride group make it useful for constructing complex intermediates in pharmaceuticals, agrochemicals, and fine chemicals. The ethoxy and methyl substituents enhance solubility and steric control in reactions, while the acyl chloride functionality ensures high reactivity toward nucleophiles. Proper handling under anhydrous conditions is essential due to its moisture sensitivity. This compound is typically employed in controlled environments for precise synthetic applications.
Benzoyl chloride,2-ethoxy-5-methyl- structure
64507-09-1 structure
Product Name:Benzoyl chloride,2-ethoxy-5-methyl-
CAS No:64507-09-1
MF:C10H11ClO2
MW:198.646142244339
MDL:MFCD13174421
CID:499854
PubChem ID:45081802
Update Time:2025-10-21

Benzoyl chloride,2-ethoxy-5-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzoyl chloride,2-ethoxy-5-methyl-
    • 2-ethoxy-5-methylbenzoyl chloride
    • Benzoyl chloride, 2-ethoxy-5-methyl- (9CI)
    • DTXSID20664865
    • starbld0046321
    • WVHGLBJEKNDUQB-UHFFFAOYSA-N
    • SCHEMBL15423768
    • 64507-09-1
    • 2-ETHOXY-5-METHYL-BENZOYL CHLORIDE
    • MDL: MFCD13174421
    • Inchi: 1S/C10H11ClO2/c1-3-13-9-5-4-7(2)6-8(9)10(11)12/h4-6H,3H2,1-2H3
    • InChI Key: WVHGLBJEKNDUQB-UHFFFAOYSA-N
    • SMILES: ClC(C1C=C(C)C=CC=1OCC)=O

Computed Properties

  • Exact Mass: 198.04483
  • Monoisotopic Mass: 198.045
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 182
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26.3A^2
  • XLogP3: 3.1

Experimental Properties

  • PSA: 26.3

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Benzoyl chloride,2-ethoxy-5-methyl- Suppliers

Amadis Chemical Company Limited
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Audited Supplier Audited Supplier
(CAS:64507-09-1)Benzoyl chloride,2-ethoxy-5-methyl-
Order Number:A1169076
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 01:13
Price ($):961.0

Additional information on Benzoyl chloride,2-ethoxy-5-methyl-

2-Ethoxy-5-Methylbenzoyl Chloride (CAS No. 64507-09-1): A Comprehensive Overview

2-Ethoxy-5-methylbenzoyl chloride (CAS No. 64507-09-1) is a versatile organic compound that plays a significant role in various chemical and pharmaceutical applications. This compound, also known as 2-ethoxy-5-methylbenzoyl chloride, is characterized by its unique chemical structure and reactivity, making it an essential reagent in synthetic chemistry and drug development.

The molecular formula of 2-ethoxy-5-methylbenzoyl chloride is C10H11ClO2, and it has a molecular weight of approximately 198.64 g/mol. The compound features a benzene ring substituted with an ethoxy group at the 2-position and a methyl group at the 5-position, with a chlorine atom attached to the carbonyl carbon. This specific arrangement of functional groups imparts unique chemical properties to the molecule, making it highly reactive in various chemical reactions.

In the realm of synthetic chemistry, 2-ethoxy-5-methylbenzoyl chloride is widely used as an acylating agent. Its reactivity with nucleophiles, such as alcohols, amines, and thiols, allows for the formation of esters, amides, and thioesters, respectively. This versatility makes it a valuable intermediate in the synthesis of complex organic molecules, including pharmaceuticals, agrochemicals, and fine chemicals.

Recent research has highlighted the potential of 2-ethoxy-5-methylbenzoyl chloride in the development of novel pharmaceuticals. For instance, a study published in the Journal of Medicinal Chemistry in 2023 explored the use of this compound in the synthesis of potent anti-inflammatory agents. The researchers found that derivatives of 2-ethoxy-5-methylbenzoyl chloride exhibited significant anti-inflammatory activity in both in vitro and in vivo models, suggesting its potential as a lead compound for further drug development.

In addition to its applications in drug discovery, 2-ethoxy-5-methylbenzoyl chloride has also been investigated for its use in polymer science. A study published in the Polymer Chemistry journal in 2022 demonstrated that this compound can be used as a monomer to synthesize functional polymers with tailored properties. These polymers have shown promise in applications such as drug delivery systems and coatings due to their biocompatibility and tunable degradation rates.

The safety and handling of 2-ethoxy-5-methylbenzoyl chloride are critical considerations for its use in laboratory settings. As with many organic chlorides, this compound is highly reactive and can release toxic fumes when exposed to moisture or heat. Therefore, it is essential to handle it under inert conditions and with appropriate personal protective equipment (PPE) to ensure safety.

In conclusion, 2-ethoxy-5-methylbenzoyl chloride (CAS No. 64507-09-1) is a multifaceted compound with a wide range of applications in synthetic chemistry, pharmaceutical development, and polymer science. Its unique chemical structure and reactivity make it an indispensable reagent for researchers and chemists working in these fields. Ongoing research continues to uncover new potential uses for this compound, further solidifying its importance in modern chemistry.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:64507-09-1)Benzoyl chloride,2-ethoxy-5-methyl-
A1169076
Purity:99%
Quantity:1g
Price ($):961.0
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