Cas no 103213-46-3 (D-Fructofuranose,1-(dihydrogen phosphate), disodium salt (9CI))

D-Fructofuranose,1-(dihydrogen phosphate), disodium salt (9CI) structure
103213-46-3 structure
Product Name:D-Fructofuranose,1-(dihydrogen phosphate), disodium salt (9CI)
CAS No:103213-46-3
MF:C6H11Na2O9P
MW:304.099445581436
CID:125530
PubChem ID:122129543
Update Time:2025-04-18

D-Fructofuranose,1-(dihydrogen phosphate), disodium salt (9CI) Chemical and Physical Properties

Names and Identifiers

    • D-Fructofuranose,1-(dihydrogen phosphate), disodium salt (9CI)
    • D-Fructose 1-phosphate sodium salt
    • D-FRUCTOSE 1-PHOSPHATE SODIUM
    • 103213-46-3
    • disodium [(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl phosphate
    • Sodium ((3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)methyl phosphate
    • Sodium((3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)methylphosphate
    • Inchi: 1S/C6H13O9P.2Na/c7-1-3-4(8)5(9)6(10,15-3)2-14-16(11,12)13;;/h3-5,7-10H,1-2H2,(H2,11,12,13);;/q;2*+1/p-2/t3-,4-,5+,6?;;/m1../s1
    • InChI Key: RMXREVINNWOITI-UHOQFTJOSA-L
    • SMILES: P(=O)([O-])([O-])OCC1([C@H]([C@@H]([C@@H](CO)O1)O)O)O.[Na+].[Na+]

Computed Properties

  • Exact Mass: 283.01949
  • Monoisotopic Mass: 303.99360749g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 278
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 163?2

Experimental Properties

  • PSA: 156.91

D-Fructofuranose,1-(dihydrogen phosphate), disodium salt (9CI) Security Information

  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: 26-36
  • Hazardous Material Identification: Xi
  • Risk Phrases:36/37/38
  • Safety Term:Hazard Codes XiRisk Statements 36/37/38Safety Statements 26-36WGK Germany 3

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