Cas no 1157057-81-2 (3-fluoro-4-(methylamino)benzonitrile)

3-fluoro-4-(methylamino)benzonitrile structure
1157057-81-2 structure
Product Name:3-fluoro-4-(methylamino)benzonitrile
CAS No:1157057-81-2
MF:C8H7FN2
MW:150.152984857559
MDL:MFCD12109949
CID:840172
PubChem ID:21029569
Update Time:2025-04-19

3-fluoro-4-(methylamino)benzonitrile Chemical and Physical Properties

Names and Identifiers

    • 3-fluoro-4-(methylamino)benzonitrile
    • AC1Q40W1
    • AK145554
    • AM807112
    • CTK8E4461
    • MolPort-011-991-931
    • SureCN9232027
    • SB76438
    • DB-294261
    • 1157057-81-2
    • Z445160706
    • AKOS009852118
    • SCHEMBL9232027
    • I11059
    • EN300-64707
    • AS-49506
    • MFCD12109949
    • Benzonitrile, 3-fluoro-4-(methylamino)-
    • MDL: MFCD12109949
    • Inchi: 1S/C8H7FN2/c1-11-8-3-2-6(5-10)4-7(8)9/h2-4,11H,1H3
    • InChI Key: SNOXQSJLHWBCBF-UHFFFAOYSA-N
    • SMILES: FC1C=C(C#N)C=CC=1NC

Computed Properties

  • Exact Mass: 150.05932639g/mol
  • Monoisotopic Mass: 150.05932639g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 172
  • 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: 35.8?2

3-fluoro-4-(methylamino)benzonitrile Pricemore >>

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abcr
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abcr
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