Cas no 28442-78-6 (2-Chloroisophthalonitrile)

2-Chloroisophthalonitrile structure
2-Chloroisophthalonitrile structure
Product Name:2-Chloroisophthalonitrile
CAS No:28442-78-6
MF:C8H3ClN2
MW:162.575820207596
MDL:MFCD01657061
CID:53325
PubChem ID:206674
Update Time:2025-04-18

2-Chloroisophthalonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-Chloroisophthalonitrile
    • 1-CHLORO-2,6-DICYANOBENZENE
    • 2-chlorobenzene-1,3-dicarbonitrile
    • 1,3-Benzenedicarbonitrile,2-chloro
    • 2,6-Dicyanochlorobenzene
    • 2-Chlorisophthalonitril
    • 2-Chloro-1,3-benzenedicarbonitrile
    • 2-chloro-1,3-dicyanobenzene
    • chloroisophthalonitrile
    • SCHEMBL3237062
    • 28442-78-6
    • DTXSID90182642
    • BRN 2253494
    • CHEMBL3248166
    • AKOS006278992
    • 1,3-Benzenedicarbonitrile, 2-chloro-
    • KELQMIQLTBTJNV-UHFFFAOYSA-N
    • MFCD01657061
    • NS00067219
    • 1,3-Benzenedicarbonitrile, chloro-
    • 2-chlorobenzene-1, 3-dicarbonitrile
    • CS-0188273
    • FT-0658907
    • DS-2637
    • A20474
    • AM61884
    • C8H3ClN2
    • AC-9681
    • DB-067929
    • MDL: MFCD01657061
    • Inchi: 1S/C8H3ClN2/c9-8-6(4-10)2-1-3-7(8)5-11/h1-3H
    • InChI Key: KELQMIQLTBTJNV-UHFFFAOYSA-N
    • SMILES: ClC1C(C#N)=CC=CC=1C#N

Computed Properties

  • Exact Mass: 161.99800
  • Monoisotopic Mass: 161.998
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 207
  • 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
  • Topological Polar Surface Area: 47.6A^2
  • XLogP3: 2

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.34
  • Melting Point: No data available
  • Boiling Point: 294.4°C at 760 mmHg
  • Flash Point: 135.6°C
  • Refractive Index: 1.586
  • PSA: 47.58000
  • LogP: 2.08336
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

2-Chloroisophthalonitrile Security Information

2-Chloroisophthalonitrile Customs Data

  • HS CODE:2926909090
  • Customs Data:

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. 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:

    HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

2-Chloroisophthalonitrile Pricemore >>

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