ChemSpider 2D Image | 4-Nitrophenyl b-D-cellotrioside | C24H35NO18

4-Nitrophenyl b-D-cellotrioside

  • Molecular FormulaC24H35NO18
  • Average mass625.531 Da
  • Monoisotopic mass625.185425 Da
  • ChemSpider ID25057937

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

106927-48-4 [RN]
4-Nitrophenyl b-D-cellotrioside
4-Nitrophenyl β-D-cellotrioside
4-Nitrophenyl β-D-glucopyranosyl-(1->4)-β-D-glucopyranosyl-(1->4)-β-D-glucopyranoside [ACD/IUPAC Name]
4-Nitrophenyl-β-D-glucopyranosyl-(1->4)-β-D-glucopyranosyl-(1->4)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside, 4-nitrophenyl O-β-D-glucopyranosyl-(1->4)-O-β-D-glucopyranosyl-(1->4)- [ACD/Index Name]
β-D-Glucopyranosyl-(1->4)-β-D-glucopyranosyl-(1->4)-β-D-glucopyranoside de 4-nitrophényle [French] [ACD/IUPAC Name]
[106927-48-4] [RN]
4-Nitrophenyl ?-D-cellotrioside
4-nitrophenyl O-?-D-glucopyranosyl-(1?4)-O-?-D-glucopyranosyl-(1?4)-?-D-glucopyranoside
More...

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 971.0±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 148.2±3.0 kJ/mol
    Flash Point: 541.1±34.3 °C
    Index of Refraction: 1.685
    Molar Refractivity: 135.5±0.4 cm3
    #H bond acceptors: 19
    #H bond donors: 10
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 3
    ACD/LogP: -1.88
    ACD/LogD (pH 5.5): -2.82
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.82
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 304 Å2
    Polarizability: 53.7±0.5 10-24cm3
    Surface Tension: 110.3±5.0 dyne/cm
    Molar Volume: 356.4±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement