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Search term: CBIDVWSRUUODHL-OVHBTUCOSA-L (Found by InChIKey (full match))

ChemSpider 2D Image | 1-C-(Hydroxymethyl)-6-O-phosphonato-alpha-D-altropyranose | C7H13O10P

1-C-(Hydroxymethyl)-6-O-phosphonato-α-D-altropyranose

  • Molecular FormulaC7H13O10P
  • Average mass288.147 Da
  • Monoisotopic mass288.025726 Da
  • ChemSpider ID58827317
  • Charge - Charge

    defined stereocentres - 5 of 5 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-C-(Hydroxymethyl)-6-O-phosphonato-α-D-altropyranose [German] [ACD/IUPAC Name]
1-C-(Hydroxymethyl)-6-O-phosphonato-α-D-altropyranose [ACD/IUPAC Name]
1-C-(Hydroxyméthyl)-6-O-phosphonato-α-D-altropyranose [French] [ACD/IUPAC Name]
α-D-altro-2-Heptulopyranose, 7-(dihydrogen phosphate), ion(2-) [ACD/Index Name]
7-O-phosphonato-α-D-altro-hept-2-ulopyranose
α-D-altro-hept-2-ulopyranose 7-phosphate
α-D-sedoheptulopyranose 7-phosphate
α-D-sedoheptulopyranose 7-phosphate(2-)
α-D-sedoheptulose 7-phosphate(2-)
  • Miscellaneous
    • Chemical Class:

      An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of alpha-D-sedoheptulopyranose 7-phosphate; major species at pH 7.3. ChEBI CHEBI:133984

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point: 614.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 104.5±6.0 kJ/mol
Flash Point: 325.4±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.09
ACD/LogD (pH 5.5): -5.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 193 Å2
Polarizability:
Surface Tension:
Molar Volume:

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