Cas no 898785-26-7 ( )

  structure
  structure
Product Name: 
CAS No:898785-26-7
MF:C13H17ClO
MW:224.726483106613
CID:875470
PubChem ID:24723969
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • 6-Chloro-1-(3-methylphenyl)-1-oxohexane
    • 6-chloro-1-(3-methylphenyl)hexan-1-one
    • DTXSID00642368
    • AKOS016019497
    • 898785-26-7
    • MFCD03841054
    •  
    • MDL: MFCD03841054
    • Inchi: 1S/C13H17ClO/c1-11-6-5-7-12(10-11)13(15)8-3-2-4-9-14/h5-7,10H,2-4,8-9H2,1H3
    • InChI Key: CLPZJWYVYQWTPV-UHFFFAOYSA-N
    • SMILES: ClCCCCCC(C1C=CC=C(C)C=1)=O

Computed Properties

  • Exact Mass: 224.09700
  • Monoisotopic Mass: 224.0967929g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 6
  • Complexity: 191
  • 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: 3.6
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 3.97690

  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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