Cas no 164642-63-1 (4-(2,6-dimethylphenyl)butan-1-amine)

4-(2,6-dimethylphenyl)butan-1-amine structure
164642-63-1 structure
Product Name:4-(2,6-dimethylphenyl)butan-1-amine
CAS No:164642-63-1
MF:C12H19N
MW:177.28596329689
CID:6196807
PubChem ID:80503121
Update Time:2024-01-11

4-(2,6-dimethylphenyl)butan-1-amine Chemical and Physical Properties

Names and Identifiers

    • 4-(2,6-dimethylphenyl)butan-1-amine
    • AKOS019067506
    • 164642-63-1
    • EN300-1849604
    • Inchi: 1S/C12H19N/c1-10-6-5-7-11(2)12(10)8-3-4-9-13/h5-7H,3-4,8-9,13H2,1-2H3
    • InChI Key: SUKDIVZHEOOWKY-UHFFFAOYSA-N
    • SMILES: NCCCCC1C(C)=CC=CC=1C

Computed Properties

  • Exact Mass: 177.151749610g/mol
  • Monoisotopic Mass: 177.151749610g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 123
  • 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: 2.7
  • Topological Polar Surface Area: 26?2

4-(2,6-dimethylphenyl)butan-1-amine Pricemore >>

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