Cas no 82259-50-5 (D-Allose,6-(dihydrogen phosphate))

D-Allose,6-(dihydrogen phosphate) structure
82259-50-5 structure
Product Name:D-Allose,6-(dihydrogen phosphate)
CAS No:82259-50-5
MF:C6H12O8P
MW:243.128443717957
CID:720546
PubChem ID:71431266
Update Time:2025-04-19

D-Allose,6-(dihydrogen phosphate) Chemical and Physical Properties

Names and Identifiers

    • D-Allose,6-(dihydrogen phosphate)
    • D-ALLOSE-6-PHOSPHATE
    • D-ALLOSE-6-PHOSPHATE DISODIUM SALT HYDRATE
    • hydroxy-oxo-[(2R,3R,4R,5R)-2,3,4,5-tetrahydroxy-6-oxohexoxy]phosphanium
    • DTXSID90849400
    • 82259-50-5
    • [(1R,4S)-4-HYDROXY-2-CYCLOPENTEN-1-YL]CARBAMICACID,1,1-DIMETHYLETHYLESTER
    • 6-O-[Hydroxy(oxo)phosphaniumyl]-D-allose
    • [(2R,3R,4R,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl]oxyphosphinic acid
    • Inchi: 1S/C6H11O8P/c7-1-3(8)5(10)6(11)4(9)2-14-15(12)13/h1,3-6,8-11H,2H2/p+1/t3-,4+,5-,6+/m0/s1
    • InChI Key: RHCXLYOURNFJRR-BGPJRJDNSA-O
    • SMILES: [P+](=O)(O)OC[C@H]([C@H]([C@H]([C@H](C=O)O)O)O)O

Computed Properties

  • Exact Mass: 243.02697933g/mol
  • Monoisotopic Mass: 243.02697933g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 7
  • Complexity: 221
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -3.3
  • Topological Polar Surface Area: 145?2

Experimental Properties

  • Density: 1.832
  • Boiling Point: 667.8 °C at 760 mmHg
  • Flash Point: 357.7 °C
  • PSA: 166.72000
  • LogP: -3.10440

D-Allose,6-(dihydrogen phosphate) Pricemore >>

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