Cas no 1200131-07-2 (4-Bromo-2,6-diethylbenzonitrile)

4-Bromo-2,6-diethylbenzonitrile structure
1200131-07-2 structure
Product Name:4-Bromo-2,6-diethylbenzonitrile
CAS No:1200131-07-2
MF:C11H12BrN
MW:238.123682022095
MDL:MFCD18917122
CID:1101520
PubChem ID:53256763
Update Time:2025-09-27

4-Bromo-2,6-diethylbenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-2,6-diethylbenzonitrile
    • 3,5-dichllor-4-fluoro-1-bromobenzene
    • 3,5-Dichloro-4-fluorobromobenzene
    • 4-Bromo-2,6-dichloro-fluorobenzene
    • ACMC-209e5x
    • ACT03074
    • CTK3J4748
    • KSC494O4R
    • PubChem23061
    • SureCN6600235
    • SCHEMBL1427328
    • BS-50048
    • A856900
    • MFCD18917122
    • 1200131-07-2
    • DB-316295
    • 4-bromo-2,6-diethylbenzonitrile;
    • CS-0366761
    • IAMOUWSOUQOSDV-UHFFFAOYSA-N
    • Benzonitrile, 4-bromo-2,6-diethyl-
    • MDL: MFCD18917122
    • Inchi: 1S/C11H12BrN/c1-3-8-5-10(12)6-9(4-2)11(8)7-13/h5-6H,3-4H2,1-2H3
    • InChI Key: IAMOUWSOUQOSDV-UHFFFAOYSA-N
    • SMILES: BrC1C=C(CC)C(C#N)=C(C=1)CC

Computed Properties

  • Exact Mass: 237.01531g/mol
  • Monoisotopic Mass: 237.01531g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • 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: 3.9
  • Topological Polar Surface Area: 23.8?2

Experimental Properties

  • Density: 1.33±0.1 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 290.6±35.0 oC (760 Torr),
  • Flash Point: 129.6±25.9 oC,
  • Solubility: Almost insoluble (0.011 g/l) (25 o C),

4-Bromo-2,6-diethylbenzonitrile Pricemore >>

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