Cas no 898769-55-6 (Cyclopentyl 2-(4-methylphenyl)ethyl ketone)

Cyclopentyl 2-(4-methylphenyl)ethyl ketone is a specialized organic compound featuring a cyclopentyl group linked to a ketone functionality adjacent to a 4-methylphenylethyl moiety. This structure imparts unique reactivity and versatility, making it valuable as an intermediate in fine chemical synthesis, particularly in pharmaceuticals and agrochemicals. Its aromatic methyl substitution enhances stability while allowing further functionalization, and the cyclopentyl ring contributes to conformational rigidity, which can influence stereoselective reactions. The ketone group offers a reactive site for reductions, condensations, or nucleophilic additions. Suitable for controlled reactions under standard conditions, it is typically handled with inert atmosphere protocols due to its sensitivity. Purity and consistency are critical for reproducible results in research and industrial applications.
Cyclopentyl 2-(4-methylphenyl)ethyl ketone structure
898769-55-6 structure
Product Name:Cyclopentyl 2-(4-methylphenyl)ethyl ketone
CAS No:898769-55-6
MF:C15H20O
MW:216.318704605103
CID:1069760
PubChem ID:24725763
Update Time:2025-06-08

Cyclopentyl 2-(4-methylphenyl)ethyl ketone Chemical and Physical Properties

Names and Identifiers

    • Cyclopentyl 2-(4-methylphenyl)ethyl ketone
    • 1-cyclopentyl-3-(4-methylphenyl)propan-1-one
    • DTXSID10644156
    • cyclopentyl 2-(4-methylphenyl)ethyl ketone, AldrichCPR
    • MFCD03843042
    • SCHEMBL13963699
    • CYCLOPENTYL2-(4-METHYLPHENYL)ETHYLKETONE
    • 898769-55-6
    • AKOS016021519
    • MDL: MFCD03843042
    • Inchi: 1S/C15H20O/c1-12-6-8-13(9-7-12)10-11-15(16)14-4-2-3-5-14/h6-9,14H,2-5,10-11H2,1H3
    • InChI Key: GUBZCTLMYSMKCN-UHFFFAOYSA-N
    • SMILES: O=C(CCC1C=CC(C)=CC=1)C1CCCC1

Computed Properties

  • Exact Mass: 216.15100
  • Monoisotopic Mass: 216.151415257g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 220
  • 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: 17.1?2

Experimental Properties

  • Density: 1.013
  • Boiling Point: 328°C at 760 mmHg
  • Flash Point: 138.5°C
  • Refractive Index: 1.532
  • PSA: 17.07000
  • LogP: 3.68690

Cyclopentyl 2-(4-methylphenyl)ethyl ketone Customs Data

  • HS CODE:2914399090
  • Customs Data:

    China Customs Code:

    2914399090

    Overview:

    2914399090. Other aromatic ketones without other oxygen-containing groups. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:5.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acetone declared packaging

    Summary:

    2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Cyclopentyl 2-(4-methylphenyl)ethyl ketone Pricemore >>

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