Cas no 55469-88-0 (N-(Methyl-d3)-3-phenylpropylamine)

N-(Methyl-d3)-3-phenylpropylamine structure
55469-88-0 structure
Product Name:N-(Methyl-d3)-3-phenylpropylamine
CAS No:55469-88-0
MF:C10H15N
MW:152.251287698746
CID:943997
PubChem ID:57369754
Update Time:2025-04-19

N-(Methyl-d3)-3-phenylpropylamine Chemical and Physical Properties

Names and Identifiers

    • N-(Methyl-d3)-3-phenylpropylamine
    • 3-phenyl-N-(trideuteriomethyl)propan-1-amine
    • N-(Methyl-d3)-3-phen
    • N-Methyl-2H3-3-phenylpropylamin
    • 55469-88-0
    • N-(~2~H_3_)Methyl-3-phenylpropan-1-amine
    • DTXSID40724556
    • DB-320538
    • Inchi: 1S/C10H15N/c1-11-9-5-8-10-6-3-2-4-7-10/h2-4,6-7,11H,5,8-9H2,1H3/i1D3
    • InChI Key: MLHBZVFOTDJTPK-FIBGUPNXSA-N
    • SMILES: N(C([2H])([2H])[2H])CCCC1C=CC=CC=1

Computed Properties

  • Exact Mass: 152.13900
  • Monoisotopic Mass: 152.139279721g/mol
  • Isotope Atom Count: 3
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 4
  • Complexity: 84.9
  • 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: 2.5
  • Topological Polar Surface Area: 12?2

Experimental Properties

  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 227.4±19.0 °C at 760 mmHg
  • Flash Point: 97.9±13.6 °C
  • PSA: 12.03000
  • LogP: 2.22950
  • Vapor Pressure: 0.1±0.4 mmHg at 25°C

N-(Methyl-d3)-3-phenylpropylamine Security Information

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