Cas no 89822-75-3 (Phosphonic acid, [(2,4-diaminophenyl)methyl]-, diethyl ester)

Phosphonic acid, [(2,4-diaminophenyl)methyl]-, diethyl ester structure
89822-75-3 structure
Product Name:Phosphonic acid, [(2,4-diaminophenyl)methyl]-, diethyl ester
CAS No:89822-75-3
MF:C11H19N2O3P
MW:258.253923654556
CID:587999
PubChem ID:14693072
Update Time:2025-04-19

Phosphonic acid, [(2,4-diaminophenyl)methyl]-, diethyl ester Chemical and Physical Properties

Names and Identifiers

    • Phosphonic acid, [(2,4-diaminophenyl)methyl]-, diethyl ester
    • 4-(diethoxyphosphorylmethyl)benzene-1,3-diamine
    • Diethyl [(2,4-diaminophenyl)methyl]phosphonate
    • DTXSID60563080
    • 89822-75-3
    • Inchi: 1S/C11H19N2O3P/c1-3-15-17(14,16-4-2)8-9-5-6-10(12)7-11(9)13/h5-7H,3-4,8,12-13H2,1-2H3
    • InChI Key: VWTDPEYVSCYKER-UHFFFAOYSA-N
    • SMILES: P(CC1C=CC(=CC=1N)N)(=O)(OCC)OCC

Computed Properties

  • Exact Mass: 258.11332947g/mol
  • Monoisotopic Mass: 258.11332947g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 6
  • Complexity: 265
  • 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: 0.3
  • Topological Polar Surface Area: 87.6?2
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