Cas no 61350-39-8 (Benzenamine, 4,5-dimethoxy-2-[1-[(4-methoxyphenyl)methyl]propyl]-)

Benzenamine, 4,5-dimethoxy-2-[1-[(4-methoxyphenyl)methyl]propyl]- structure
61350-39-8 structure
Product Name:Benzenamine, 4,5-dimethoxy-2-[1-[(4-methoxyphenyl)methyl]propyl]-
CAS No:61350-39-8
MF:C19H25NO3
MW:315.406705617905
CID:482942
PubChem ID:71396680
Update Time:2025-04-19

Benzenamine, 4,5-dimethoxy-2-[1-[(4-methoxyphenyl)methyl]propyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 4,5-dimethoxy-2-[1-[(4-methoxyphenyl)methyl]propyl]-
    • 4,5-dimethoxy-2-[1-(4-methoxyphenyl)butan-2-yl]aniline
    • DTXSID40818227
    • 61350-39-8
    • Inchi: 1S/C19H25NO3/c1-5-14(10-13-6-8-15(21-2)9-7-13)16-11-18(22-3)19(23-4)12-17(16)20/h6-9,11-12,14H,5,10,20H2,1-4H3
    • InChI Key: DJXNXYCSRVSGPT-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=CC(=C(C=1)C(CC)CC1C=CC(=CC=1)OC)N)OC

Computed Properties

  • Exact Mass: 315.18355
  • Monoisotopic Mass: 315.18344366g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 7
  • Complexity: 331
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.2
  • Topological Polar Surface Area: 53.7?2

Experimental Properties

  • PSA: 53.71
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