Cas no 61921-65-1 (Hexanedioic acid, 3-(diethoxyphosphinyl)-)

Hexanedioic acid, 3-(diethoxyphosphinyl)- structure
61921-65-1 structure
Product Name:Hexanedioic acid, 3-(diethoxyphosphinyl)-
CAS No:61921-65-1
MF:C10H19O7P
MW:282.227424860001
CID:463060
PubChem ID:71391158
Update Time:2025-04-19

Hexanedioic acid, 3-(diethoxyphosphinyl)- Chemical and Physical Properties

Names and Identifiers

    • Hexanedioic acid, 3-(diethoxyphosphinyl)-
    • 3-diethoxyphosphorylhexanedioic acid
    • 3-(Diethoxyphosphoryl)hexanedioic acid
    • DTXSID80813039
    • 61921-65-1
    • Inchi: 1S/C10H19O7P/c1-3-16-18(15,17-4-2)8(7-10(13)14)5-6-9(11)12/h8H,3-7H2,1-2H3,(H,11,12)(H,13,14)
    • InChI Key: RSITYOPRJGIDQP-UHFFFAOYSA-N
    • SMILES: P(C(CC(=O)O)CCC(=O)O)(=O)(OCC)OCC

Computed Properties

  • Exact Mass: 282.08687
  • Monoisotopic Mass: 282.08683994g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 10
  • Complexity: 318
  • 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: -0.4
  • Topological Polar Surface Area: 110?2

Experimental Properties

  • PSA: 110.13
  • LogP: 1.96060
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