Cas no 86225-73-2 (3-Chloro-2,6-difluorobenzonitrile)

3-Chloro-2,6-difluorobenzonitrile structure
86225-73-2 structure
Product Name:3-Chloro-2,6-difluorobenzonitrile
CAS No:86225-73-2
MF:C7H2ClF2N
MW:173.547287464142
MDL:MFCD06660172
CID:90938
PubChem ID:13175231
Update Time:2024-10-26

3-Chloro-2,6-difluorobenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 3-Chloro-2,6-difluorobenzonitrile
    • Benzonitrile, 3-chloro-2,6-difluoro-
    • KSC495C2B
    • QYALCKFGISNFMJ-UHFFFAOYSA-N
    • 3-CHLORO-2,6-DIFLUOROBEN
    • 3475AC
    • CL8186
    • SBB088796
    • 3-chloro-2,6-difluorobenzenecarbonitrile
    • ST24042002
    • 3-Chloro-2,6-difluorobenzonitrile (ACI)
    • DTXSID70524824
    • AKOS015848823
    • SY107877
    • 86225-73-2
    • MFCD06660172
    • CS-W017544
    • DS-16706
    • 3-Chloro-2,6-difluoro-benzonitrile
    • SB74685
    • SCHEMBL1462923
    • MDL： MFCD06660172
    • Inchi： 1S/C7H2ClF2N/c8-5-1-2-6(9)4(3-11)7(5)10/h1-2H
    • InChI Key： QYALCKFGISNFMJ-UHFFFAOYSA-N
    • SMILES： N#CC1C(F)=C(Cl)C=CC=1F

Computed Properties

  • Exact Mass: 172.98400
  • Monoisotopic Mass: 172.984383
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 188
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.5
  • Topological Polar Surface Area: 23.8

Experimental Properties

  • Color/Form: Colorless liquid
  • Density: 1.43±0.1 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 198.0±35.0 oC (760 Torr),
  • Flash Point: 73.6±25.9 oC,
  • Refractive Index: 1.5125
  • Solubility: Almost insoluble (0.019 g/l) (25 o C),
  • Water Partition Coefficient: Not miscible or difficult to mix with water.
  • PSA: 23.79000
  • LogP: 2.48988
  • Solubility: Not determined

3-Chloro-2,6-difluorobenzonitrile Security Information

  • Hazardous Material Identification： Xn
  • HazardClass：6.1

3-Chloro-2,6-difluorobenzonitrile 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%

3-Chloro-2,6-difluorobenzonitrile Pricemore >>

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Chemenu
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3-Chloro-2,6-difluorobenzonitrile Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Ammonia
2.1 Reagents: Potassium fluoride
Reference
2,6-Difluorobenzonitrile
, European Patent Organization, , ,

Production Method 2

Reaction Conditions
1.1 Reagents: Potassium fluoride
Reference
2,6-Difluorobenzonitrile
, European Patent Organization, , ,

3-Chloro-2,6-difluorobenzonitrile Raw materials

3-Chloro-2,6-difluorobenzonitrile Preparation Products

3-Chloro-2,6-difluorobenzonitrile Related Literature

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