Cas no 890099-14-6 (3-Acetoxy-2',6'-dimethylbenzophenone)

3-Acetoxy-2',6'-dimethylbenzophenone is a benzophenone derivative characterized by the presence of an acetoxy group at the 3-position and methyl substituents at the 2' and 6' positions of the phenyl ring. This structural configuration enhances its utility as an intermediate in organic synthesis, particularly in photochemical applications and the preparation of UV-absorbing compounds. The acetoxy group provides reactivity for further functionalization, while the dimethyl substitution contributes to steric stabilization and controlled reactivity. Its well-defined molecular structure ensures consistency in synthetic processes, making it suitable for research and industrial applications requiring precise chemical modifications. The compound is typically handled under standard laboratory conditions, with attention to stability and compatibility.
3-Acetoxy-2',6'-dimethylbenzophenone structure
890099-14-6 structure
Product Name:3-Acetoxy-2',6'-dimethylbenzophenone
CAS No:890099-14-6
MF:C17H16O3
MW:268.307145118713
CID:878267
PubChem ID:24722987
Update Time:2025-05-21

3-Acetoxy-2',6'-dimethylbenzophenone Chemical and Physical Properties

Names and Identifiers

    • [3-(2,6-dimethylbenzoyl)phenyl] acetate
    • 3-Acetoxy-2',6'-dimethylbenzophenone
    • DTXSID10641680
    • MFCD07698929
    • 3-(2,6-Dimethylbenzoyl)phenyl acetate
    • 890099-14-6
    • AKOS016018163
    • MDL: MFCD07698929
    • Inchi: 1S/C17H16O3/c1-11-6-4-7-12(2)16(11)17(19)14-8-5-9-15(10-14)20-13(3)18/h4-10H,1-3H3
    • InChI Key: ZFPBUHFWEAMTSS-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=C(C=1)OC(C)=O)C1C(C)=CC=CC=1C

Computed Properties

  • Exact Mass: 268.11000
  • Monoisotopic Mass: 268.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 4
  • Complexity: 353
  • 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
  • XLogP3: 3.7
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • Density: 1.128
  • Boiling Point: 369.5°C at 760 mmHg
  • Flash Point: 161°C
  • Refractive Index: 1.561
  • PSA: 43.37000
  • LogP: 3.45970

3-Acetoxy-2',6'-dimethylbenzophenone Customs Data

  • HS CODE:2915390090
  • Customs Data:

    China Customs Code:

    2915390090

    Overview:

    2915390090. Other acetate esters. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:5.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food
    M.Import commodity inspection
    N.Export commodity inspection

    Summary:

    2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

3-Acetoxy-2',6'-dimethylbenzophenone Pricemore >>

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Additional information on 3-Acetoxy-2',6'-dimethylbenzophenone

3-Acetoxy-2',6'-dimethylbenzophenone: A Comprehensive Overview

The compound with CAS No 890099-14-6, commonly referred to as 3-Acetoxy-2',6'-dimethylbenzophenone, is a significant molecule in the field of organic chemistry and materials science. This compound has garnered attention due to its unique structural properties and potential applications in various industries. In this article, we delve into the details of its structure, synthesis, properties, and recent advancements in its utilization.

3-Acetoxy-2',6'-dimethylbenzophenone is an aromatic compound characterized by a benzophenone backbone with specific substituents. The molecule features an acetoxy group (-OAc) at the 3-position of one benzene ring and two methyl groups (-CH?) at the 2' and 6' positions of the other benzene ring. This substitution pattern imparts unique electronic and steric properties to the molecule, making it versatile for various chemical reactions and applications.

Recent studies have highlighted the importance of 3-Acetoxy-2',6'-dimethylbenzophenone in the development of advanced materials. Researchers have explored its role as a precursor in the synthesis of functional polymers and as a building block in organic electronics. The compound's ability to undergo nucleophilic aromatic substitution reactions has been extensively studied, providing insights into its reactivity under different conditions.

The synthesis of 3-Acetoxy-2',6'-dimethylbenzophenone typically involves multi-step organic reactions, including Friedel-Crafts acylation and alkylation processes. Recent advancements in catalytic methods have enabled more efficient and selective syntheses, reducing production costs and environmental impact. These improvements have made the compound more accessible for industrial applications.

In terms of physical properties, 3-Acetoxy-2',6'-dimethylbenzophenone exhibits a high melting point due to its rigid aromatic structure and strong intermolecular forces. Its solubility in organic solvents makes it suitable for use in solution-based chemical processes. Additionally, the compound demonstrates moderate UV absorption characteristics, which are advantageous in applications such as UV stabilizers and photoresists.

Recent research has also focused on the biological activity of 3-Acetoxy-2',6'-dimethylbenzophenone. Studies have shown that this compound exhibits potential anti-inflammatory and antioxidant properties, making it a candidate for further investigation in pharmaceutical research. Collaborative efforts between chemists and biologists are ongoing to explore its therapeutic potential.

The demand for 3-Acetoxy-2',6'-dimethylbenzophenone has been rising due to its increasing use in specialty chemicals, coatings, and advanced materials. Its compatibility with various industrial processes ensures its relevance in both academic research and commercial production.

In conclusion, 3-Acetoxy-2',6'-dimethylbenzophenone (CAS No 890099-14-6) is a multifaceted compound with promising applications across diverse fields. Ongoing research continues to uncover new opportunities for its use, solidifying its position as an essential molecule in modern chemistry.

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