Cas no 141614-04-2 (1,3-Benzenediamine,4-ethoxy-6-methyl-)

1,3-Benzenediamine,4-ethoxy-6-methyl- structure
141614-04-2 structure
Product Name:1,3-Benzenediamine,4-ethoxy-6-methyl-
CAS No:141614-04-2
MF:C9H14N2O
MW:166.220262050629
CID:101483
PubChem ID:15801091
Update Time:2025-04-18

1,3-Benzenediamine,4-ethoxy-6-methyl- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Benzenediamine,4-ethoxy-6-methyl-
    • 4-ethoxy-6-methylbenzene-1,3-diamine
    • 141614-04-2
    • SCHEMBL148285
    • 2,4-diamino-5-methylphenetol
    • DTXSID60578432
    • Inchi: 1S/C9H14N2O/c1-3-12-9-4-6(2)7(10)5-8(9)11/h4-5H,3,10-11H2,1-2H3
    • InChI Key: AYAKPRUPZTWPLK-UHFFFAOYSA-N
    • SMILES: O(CC)C1=CC(C)=C(C=C1N)N

Computed Properties

  • Exact Mass: 166.11072
  • Monoisotopic Mass: 166.110613074g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 141
  • 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: 1.3
  • Topological Polar Surface Area: 61.3?2

Experimental Properties

  • PSA: 61.27
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