ChemSpider 2D Image | (2xi)-2-Deoxy-2-{[methyl(nitroso)carbamoyl]amino}-beta-D-arabino-hexopyranose | C8H15N3O7

(2ξ)-2-Deoxy-2-{[methyl(nitroso)carbamoyl]amino}-β-D-arabino-hexopyranose

  • Molecular FormulaC8H15N3O7
  • Average mass265.221 Da
  • Monoisotopic mass265.091003 Da
  • ChemSpider ID21112725

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(2ξ)-2-Deoxy-2-{[methyl(nitroso)carbamoyl]amino}-β-D-arabino-hexopyranose [ACD/IUPAC Name]
(2ξ)-2-Desoxy-2-{[methyl(nitroso)carbamoyl]amino}-β-D-arabino-hexopyranose [German] [ACD/IUPAC Name]
(2ξ)-2-Désoxy-2-{[méthyl(nitroso)carbamoyl]amino}-β-D-arabino-hexopyranose [French] [ACD/IUPAC Name]
β-D-arabino-Hexopyranose, 2-deoxy-2-[[(methylnitrosoamino)carbonyl]amino]-, (2ξ)- [ACD/Index Name]
1-methyl-1-nitroso-3-[(2R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea
MFCD00006607 [MDL number]
Streptozocin [INN] [USAN]
streptozocin (stz)

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

    Density: 1.9±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.670
    Molar Refractivity: 53.2±0.5 cm3
    #H bond acceptors: 10
    #H bond donors: 5
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 2
    ACD/LogP: -1.33
    ACD/LogD (pH 5.5): -1.43
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.97
    ACD/LogD (pH 7.4): -1.45
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.82
    Polar Surface Area: 152 Å2
    Polarizability: 21.1±0.5 10-24cm3
    Surface Tension: 81.2±7.0 dyne/cm
    Molar Volume: 142.5±7.0 cm3

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