Cas no 181481-62-9 ((R)-1-(Benzo[d][1,3]dioxol-5-yl)butan-1-amine)

(R)-1-(Benzo[d][1,3]dioxol-5-yl)butan-1-amine structure
181481-62-9 structure
Product Name:(R)-1-(Benzo[d][1,3]dioxol-5-yl)butan-1-amine
CAS No:181481-62-9
MF:C11H15NO2
MW:193.242303133011
CID:835529
PubChem ID:10726439
Update Time:2023-10-30

(R)-1-(Benzo[d][1,3]dioxol-5-yl)butan-1-amine Chemical and Physical Properties

Names and Identifiers

    • (R)-1-(Benzo[d][1,3]dioxol-5-yl)butan-1-amine
    • (1R)-1-(1,3-benzodioxol-5-yl)butan-1-amine
    • (R)-α-propylpiperonylaMine
    • (R)-1-Benzo[1,3]dioxol-5-yl-butylaMine
    • 181481-62-9
    • (1R)-1-(1,3-Benzodioxol-5-yl)-1-butanamine
    • (R)-1-(1,3-Benzodioxole-5-yl)-1-butanamine
    • CS-0005928
    • DTXSID10443984
    • SCHEMBL7392624
    • MDL: MFCD09251283
    • Inchi: 1S/C11H15NO2/c1-2-3-9(12)8-4-5-10-11(6-8)14-7-13-10/h4-6,9H,2-3,7,12H2,1H3/t9-/m1/s1
    • InChI Key: DFTBFIMTDRVUQC-SECBINFHSA-N
    • SMILES: O1COC2=CC=C(C=C12)[C@@H](CCC)N

Computed Properties

  • Exact Mass: 193.110278721g/mol
  • Monoisotopic Mass: 193.110278721g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 186
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 44.5?2
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