Cas no 898776-56-2 (Ethyl 4-(1-oxo-2-phenylethyl)benzoate)

Ethyl 4-(1-oxo-2-phenylethyl)benzoate structure
898776-56-2 structure
Product Name:Ethyl 4-(1-oxo-2-phenylethyl)benzoate
CAS No:898776-56-2
MF:C17H16O3
MW:268.307145118713
CID:878259
PubChem ID:24727460
Update Time:2025-04-19

Ethyl 4-(1-oxo-2-phenylethyl)benzoate Chemical and Physical Properties

Names and Identifiers

    • ethyl 4-(2-phenylacetyl)benzoate
    • Ethyl 4-(1-oxo-2-phenylethyl)benzoate
    • MFCD07700159
    • DTXSID60645678
    • Ethyl 4-(phenylacetyl)benzoate
    • AKOS016023007
    • ETHYL4-(1-OXO-2-PHENYLETHYL)BENZOATE
    • 898776-56-2
    • G71869
    • MDL: MFCD07700159
    • Inchi: 1S/C17H16O3/c1-2-20-17(19)15-10-8-14(9-11-15)16(18)12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3
    • InChI Key: CMXZPAUMRMYUIQ-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC(C(=O)OCC)=CC=1)CC1C=CC=CC=1

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: 6
  • Complexity: 323
  • 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: 3.4
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37000
  • LogP: 3.28870

Ethyl 4-(1-oxo-2-phenylethyl)benzoate Customs Data

  • HS CODE:2918300090
  • Customs Data:

    China Customs Code:

    2918300090

    Overview:

    2918300090 Other aldehydes or ketones without other oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

Ethyl 4-(1-oxo-2-phenylethyl)benzoate Pricemore >>

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