ChemSpider 2D Image | 1,5-Anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-{[(4-methyl-1,2,5-oxadiazol-3-yl)carbonyl]amino}-D-threo-pentitol | C11H15N3O6

1,5-Anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-{[(4-methyl-1,2,5-oxadiazol-3-yl)carbonyl]amino}-D-threo-pentitol

  • Molecular FormulaC11H15N3O6
  • Average mass285.253 Da
  • Monoisotopic mass285.096100 Da
  • ChemSpider ID35066556

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,5-Anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-{[(4-methyl-1,2,5-oxadiazol-3-yl)carbonyl]amino}-D-threo-pentitol [ACD/IUPAC Name]
1,5-Anhydro-2-O-(carboxymethyl)-3,4-didesoxy-3-{[(4-methyl-1,2,5-oxadiazol-3-yl)carbonyl]amino}-D-threo-pentitol [German] [ACD/IUPAC Name]
1,5-Anhydro-2-O-(carboxyméthyl)-3,4-didésoxy-3-{[(4-méthyl-1,2,5-oxadiazol-3-yl)carbonyl]amino}-D-thréo-pentitol [French] [ACD/IUPAC Name]
D-threo-Pentitol, 1,5-anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-[[(4-methyl-1,2,5-oxadiazol-3-yl)carbonyl]amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.548
Molar Refractivity: 63.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.17
ACD/LogD (pH 5.5): -2.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 124 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 199.4±5.0 cm3

Click to predict properties on the Chemicalize site


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