Cas no 898780-80-8 (2'-Chloro-3-(3,5-dimethylphenyl)propiophenone)

2'-Chloro-3-(3,5-dimethylphenyl)propiophenone structure
898780-80-8 structure
Product Name:2'-Chloro-3-(3,5-dimethylphenyl)propiophenone
CAS No:898780-80-8
MF:C17H17ClO
MW:272.769284009933
CID:870802
PubChem ID:24726512
Update Time:2025-04-19

2'-Chloro-3-(3,5-dimethylphenyl)propiophenone Chemical and Physical Properties

Names and Identifiers

    • 1-(2-chlorophenyl)-3-(3,5-dimethylphenyl)propan-1-one
    • 2'-CHLORO-3-(3,5-DIMETHYLPHENYL)PROPIOPHENONE
    • 898780-80-8
    • DTXSID20644905
    • AKOS016022272
    • MFCD03843897
    • 2'-Chloro-3-(3,5-dimethylphenyl)propiophenone
    • MDL: MFCD03843897
    • Inchi: 1S/C17H17ClO/c1-12-9-13(2)11-14(10-12)7-8-17(19)15-5-3-4-6-16(15)18/h3-6,9-11H,7-8H2,1-2H3
    • InChI Key: AQFSCTULYIPNPS-UHFFFAOYSA-N
    • SMILES: ClC1C=CC=CC=1C(CCC1C=C(C)C=C(C)C=1)=O

Computed Properties

  • Exact Mass: 272.09700
  • Monoisotopic Mass: 272.0967929g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 292
  • 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: 4.7
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 4.77230

2'-Chloro-3-(3,5-dimethylphenyl)propiophenone 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%

2'-Chloro-3-(3,5-dimethylphenyl)propiophenone Pricemore >>

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