Cas no 93132-85-5 ([(2S,3S,4S,5R)-3,4-Dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl] dihydrogen phosphate)

[(2S,3S,4S,5R)-3,4-Dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl] dihydrogen phosphate structure
93132-85-5 structure
Product Name:[(2S,3S,4S,5R)-3,4-Dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl] dihydrogen phosphate
CAS No:93132-85-5
MF:C5H12O11P2
MW:310.08970451355
CID:805661
PubChem ID:125010
Update Time:2024-03-01

[(2S,3S,4S,5R)-3,4-Dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl] dihydrogen phosphate Chemical and Physical Properties

Names and Identifiers

    • b-D-Arabinofuranose,1,5-bis(dihydrogen phosphate)
    • arabinose 1,5-diphosphate
    • Arabinose 1,5-bisphosphate
    • 1,5-di-O-phosphonopentofuranose
    • A 1,5-BP
    • [(2S,3S,4S,5R)-3,4-Dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl] dihydrogen phosphate
    • Inchi: 1S/C5H12O11P2/c6-3-2(1-14-17(8,9)10)15-5(4(3)7)16-18(11,12)13/h2-7H,1H2,(H2,8,9,10)(H2,11,12,13)/t2-,3-,4+,5+/m1/s1
    • InChI Key: AAAFZMYJJHWUPN-MBMOQRBOSA-N
    • SMILES: P(=O)(O)(O)O[C@H]1[C@H]([C@@H]([C@@H](COP(=O)(O)O)O1)O)O

Computed Properties

  • Exact Mass: 309.985484
  • Monoisotopic Mass: 309.985484
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 11
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 372
  • 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
  • Topological Polar Surface Area: 183
  • XLogP3: -4.7

Experimental Properties

  • Color/Form: Solid powder
  • Density: 2.04
  • Boiling Point: 719.2°Cat760mmHg
  • Flash Point: 388.8°C
  • Refractive Index: 1.587

[(2S,3S,4S,5R)-3,4-Dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl] dihydrogen phosphate Security Information

  • Signal Word:Warning
  • Storage Condition:Dry, dark and store at 0-4℃ for short term (days to weeks) or -20℃ for long term (Store correctly 2-3years).
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