Cas no 67818-41-1 (1-(2-Chloro-4-nitrophenyl)ethanone)

1-(2-Chloro-4-nitrophenyl)ethanone structure
67818-41-1 structure
Product Name:1-(2-Chloro-4-nitrophenyl)ethanone
CAS No:67818-41-1
MF:C8H6ClNO3
MW:199.591141223907
MDL:MFCD00017340
CID:820610
PubChem ID:354334317
Update Time:2025-04-19

1-(2-Chloro-4-nitrophenyl)ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(2-Chloro-4-nitrophenyl)ethanone
    • 2'-Chloro-4'-nitroacetophenone
    • 1-(2-CHLORO-4-NITROPHENYL)ETHAN-1-ONE
    • NSC 231605
    • 2-Chloro-4-nitroacetophenone
    • Ethanone, 1-(2-chloro-4-nitrophenyl)-
    • NSC231605
    • Maybridge1_005236
    • KSC354M9J
    • 3-chloro-4-acetyl-nitrobenzene
    • HMS556F22
    • BRFBJVQQCATLSZ-UHFFFAOYSA-N
    • 1-(2-chloro-4-nitro-phenyl)ethanone
    • CM11166
    • AS0
    • 67818-41-1
    • EN300-74497
    • MFCD00017340
    • CS-W021200
    • 1-(2-chloro-4-nitro-phenyl)-ethanone
    • AKOS006281461
    • SCHEMBL480106
    • AC-28685
    • DS-18172
    • NSC-231605
    • FT-0690608
    • DTXSID90310766
    • C3299
    • METHYL3,4-O-ISOPROPYLIDENE-L-THREONATE
    • DB-073934
    • 1-(2-chloro-4-nitrophenyl)ethan-1-one;1-(2-chloro-4-nitrophenyl)ethanone;
    • MDL: MFCD00017340
    • Inchi: 1S/C8H6ClNO3/c1-5(11)7-3-2-6(10(12)13)4-8(7)9/h2-4H,1H3
    • InChI Key: BRFBJVQQCATLSZ-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C=CC=1C(C)=O)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 199.00400
  • Monoisotopic Mass: 199.004
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 226
  • 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: 2.2
  • Topological Polar Surface Area: 62.9

Experimental Properties

  • Color/Form: No data available
  • Density: 1.378±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 43.0 to 47.0 deg-C
  • Boiling Point: 270.9±20.0 oC (760 Torr),
  • Flash Point: 117.6±21.8 oC,
  • Refractive Index: 1.573
  • Solubility: Very slightly soluble (0.2 g/l) (25 o C),
  • PSA: 62.89000
  • LogP: 2.97400

1-(2-Chloro-4-nitrophenyl)ethanone Security Information

1-(2-Chloro-4-nitrophenyl)ethanone 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%

1-(2-Chloro-4-nitrophenyl)ethanone Pricemore >>

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