Cas no 122875-03-0 (4-(3-methoxyphenyl)butan-1-amine)

4-(3-methoxyphenyl)butan-1-amine structure
122875-03-0 structure
Product Name:4-(3-methoxyphenyl)butan-1-amine
CAS No:122875-03-0
MF:C11H17NO
MW:179.258783102036
CID:1214947
PubChem ID:542611
Update Time:2025-04-20

4-(3-methoxyphenyl)butan-1-amine Chemical and Physical Properties

Names and Identifiers

    • Benzenebutanamine, 3-methoxy-
    • 4-(3-methoxyphenyl)butan-1-amine
    • 4-(3-methoxy-phenyl)-butylamine
    • CS-0457375
    • AKOS013464437
    • 122875-03-0
    • DTXSID50337419
    • 4-(3-Methoxyphenyl)-1-butanamine #
    • EN300-1867406
    • 4-(3-Methoxyphenyl)butylamine
    • SCHEMBL3285142
    • 3-Methoxy-benzenebutanamine
    • DB-348615
    • Inchi: 1S/C11H17NO/c1-13-11-7-4-6-10(9-11)5-2-3-8-12/h4,6-7,9H,2-3,5,8,12H2,1H3
    • InChI Key: NEHQMKGFIODIOM-UHFFFAOYSA-N
    • SMILES: O(C)C1=CC=CC(=C1)CCCCN

Computed Properties

  • Exact Mass: 179.131014166g/mol
  • Monoisotopic Mass: 179.131014166g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 127
  • 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: 2.3
  • Topological Polar Surface Area: 35.2?2

4-(3-methoxyphenyl)butan-1-amine Pricemore >>

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