Cas no 1501413-34-8 (2-(2-fluoro-3-methylphenyl)propan-1-amine)

2-(2-fluoro-3-methylphenyl)propan-1-amine structure
1501413-34-8 structure
Product Name:2-(2-fluoro-3-methylphenyl)propan-1-amine
CAS No:1501413-34-8
MF:C10H14FN
MW:167.223266124725
CID:6497431
PubChem ID:83695136
Update Time:2024-01-12

2-(2-fluoro-3-methylphenyl)propan-1-amine Chemical and Physical Properties

Names and Identifiers

    • 2-(2-fluoro-3-methylphenyl)propan-1-amine
    • 1501413-34-8
    • EN300-1855241
    • Inchi: 1S/C10H14FN/c1-7-4-3-5-9(10(7)11)8(2)6-12/h3-5,8H,6,12H2,1-2H3
    • InChI Key: OKDKTJASUBDTKG-UHFFFAOYSA-N
    • SMILES: FC1C(C)=CC=CC=1C(C)CN

Computed Properties

  • Exact Mass: 167.111027613g/mol
  • Monoisotopic Mass: 167.111027613g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 138
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 26?2

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