Cas no 898768-75-7 ( )

  structure
  structure
Product Name: 
CAS No:898768-75-7
MF:C16H15FO
MW:242.288108110428
CID:870123
PubChem ID:24725731
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • 1-(3-fluorophenyl)-3-(4-methylphenyl)propan-1-one
    • 3'-FLUORO-3-(4-METHYLPHENYL)PROPIOPHENONE
    • DTXSID40644124
    • MFCD07699616
    • 898768-75-7
    • AKOS016021569
    •  
    • MDL: MFCD07699616
    • Inchi: 1S/C16H15FO/c1-12-5-7-13(8-6-12)9-10-16(18)14-3-2-4-15(17)11-14/h2-8,11H,9-10H2,1H3
    • InChI Key: XBDQIXHWWCWOOP-UHFFFAOYSA-N
    • SMILES: FC1=CC=CC(=C1)C(CCC1C=CC(C)=CC=1)=O

Computed Properties

  • Exact Mass: 242.11100
  • Monoisotopic Mass: 242.110693260g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 268
  • 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: 4
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 1.108
  • Boiling Point: 374.5°C at 760 mmHg
  • Flash Point: 157.5°C
  • Refractive Index: 1.555
  • PSA: 17.07000
  • LogP: 3.94960

  Customs Data

  • HS CODE:2914700090
  • Customs Data:

    China Customs Code:

    2914700090

    Overview:

    2914700090 Halogenation of other ketones and quinones\Sulfonated derivative(Including nitrated and nitrosative derivatives). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

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

    Summary:

    HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

  Pricemore >>

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