Cas no 1235758-90-3 (4-(((3R,5S)-3,5-Dimethylmorpholino)methyl)aniline)

4-(((3R,5S)-3,5-Dimethylmorpholino)methyl)aniline structure
1235758-90-3 structure
Product Name:4-(((3R,5S)-3,5-Dimethylmorpholino)methyl)aniline
CAS No:1235758-90-3
MF:C13H20N2O
MW:220.310703277588
CID:842761
PubChem ID:71464255
Update Time:2025-04-19

4-(((3R,5S)-3,5-Dimethylmorpholino)methyl)aniline Chemical and Physical Properties

Names and Identifiers

    • 4-(((3R,5S)-3,5-Dimethylmorpholino)methyl)aniline
    • 4-[[(3S,5R)-3,5-dimethylmorpholin-4-yl]methyl]aniline
    • Benzenamine, 4-[[(3R,5S)-3,5-dimethyl-4-morpholinyl]methyl]-, rel-
    • DTXSID40856023
    • 1235758-90-3
    • 4-{[(3R,5S)-3,5-Dimethylmorpholin-4-yl]methyl}aniline
    • DB-339544
    • Inchi: 1S/C13H20N2O/c1-10-8-16-9-11(2)15(10)7-12-3-5-13(14)6-4-12/h3-6,10-11H,7-9,14H2,1-2H3/t10-,11+
    • InChI Key: HENXFLISWTXENK-PHIMTYICSA-N
    • SMILES: O1C[C@@H](C)N(CC2C=CC(=CC=2)N)[C@@H](C)C1

Computed Properties

  • Exact Mass: 220.157563266g/mol
  • Monoisotopic Mass: 220.157563266g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 204
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 38.5?2

4-(((3R,5S)-3,5-Dimethylmorpholino)methyl)aniline Pricemore >>

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