Cas no 219823-49-1 (2-Amino-4,5-difluorobenzonitrile)

2-Amino-4,5-difluorobenzonitrile structure
219823-49-1 structure
Product Name:2-Amino-4,5-difluorobenzonitrile
CAS No:219823-49-1
MF:C7H4F2N2
MW:154.116868019104
MDL:MFCD09835282
CID:252643
PubChem ID:10877330
Update Time:2025-09-22

2-Amino-4,5-difluorobenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-Amino-4,5-difluorobenzonitrile
    • Benzonitrile,2-amino-4,5-difluoro-
    • 2-amino-4,5-difluoro-benzonitrile
    • SY259212
    • CS-0037497
    • SCHEMBL404483
    • SB76009
    • AKOS006328968
    • AC-26107
    • FT-0687058
    • DTXSID20446709
    • MFCD09835282
    • WQDUYGGOVGUBMO-UHFFFAOYSA-N
    • 2-amino-4, 5-difluorobenzonitrile
    • A18463
    • Benzonitrile,2-amino-4,5-difluoro-(9CI)
    • 219823-49-1
    • Benzonitrile, 2-amino-4,5-difluoro- (9CI)
    • AS-33144
    • MDL： MFCD09835282
    • Inchi： 1S/C7H4F2N2/c8-5-1-4(3-10)7(11)2-6(5)9/h1-2H,11H2
    • InChI Key： WQDUYGGOVGUBMO-UHFFFAOYSA-N
    • SMILES： FC1C(=CC(C#N)=C(C=1)N)F

Computed Properties

  • Exact Mass: 154.03400
  • Monoisotopic Mass: 154.03425446g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 186
  • 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: 1.7
  • Topological Polar Surface Area: 49.8?2

Experimental Properties

  • Density: 1.36±0.1 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 288.7±40.0 oC (760 Torr),
  • Flash Point: 128.4±27.3 oC,
  • Solubility: Very slightly soluble (0.17 g/l) (25 o C),
  • PSA: 49.81000
  • LogP: 1.99988

2-Amino-4,5-difluorobenzonitrile Pricemore >>

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