ChemSpider 2D Image | [(7S,8R,9S)-8,9-Dihydroxy-2,4-dioxo-6-oxa-1,3-diazaspiro[4.4]non-7-yl]methyl dihydrogen phosphate | C7H11N2O9P

[(7S,8R,9S)-8,9-Dihydroxy-2,4-dioxo-6-oxa-1,3-diazaspiro[4.4]non-7-yl]methyl dihydrogen phosphate

  • Molecular FormulaC7H11N2O9P
  • Average mass298.144 Da
  • Monoisotopic mass298.020203 Da
  • ChemSpider ID71360713

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

[(7S,8R,9S)-8,9-Dihydroxy-2,4-dioxo-6-oxa-1,3-diazaspiro[4.4]non-7-yl]methyl dihydrogen phosphate [ACD/IUPAC Name]
[(7S,8R,9S)-8,9-Dihydroxy-2,4-dioxo-6-oxa-1,3-diazaspiro[4.4]non-7-yl]methyldihydrogenphosphat [German] [ACD/IUPAC Name]
6-Oxa-1,3-diazaspiro[4.4]nonane-2,4-dione, 8,9-dihydroxy-7-[(phosphonooxy)methyl]-, (7S,8R,9S)- [ACD/Index Name]
Dihydrogénophosphate de [(7S,8R,9S)-8,9-dihydroxy-2,4-dioxo-6-oxa-1,3-diazaspiro[4.4]non-7-yl]méthyle [French] [ACD/IUPAC Name]
HYDANTOCIDIN-5'-PHOSPHATE

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.656
Molar Refractivity: 54.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -5.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 184 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 120.1±5.0 dyne/cm
Molar Volume: 147.5±5.0 cm3

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