ChemSpider 2D Image | 2-Chloro-4-Nitrophenyl beta-D-Maltotriose | C24H34ClNO18

2-Chloro-4-Nitrophenyl β-D-Maltotriose

  • Molecular FormulaC24H34ClNO18
  • Average mass659.976 Da
  • Monoisotopic mass659.146423 Da
  • ChemSpider ID22901088

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

165522-16-7 [RN]
2-Chlor-4-nitrophenyl-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->;4)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
2-Chloro-4-nitrophenyl α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-β-D-glucopyranoside [ACD/IUPAC Name]
2-Chloro-4-Nitrophenyl β-D-Maltotriose
MFCD01862982 [MDL number]
α-D-Glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-β-D-glucopyranoside de 2-chloro-4-nitrophényle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 2-chloro-4-nitrophenyl O-α-D-glucopyranosyl-(1->4)-O-α-D-glucopyranosyl-(1->4)- [ACD/Index Name]
(2R,3R,4S,5S,6R)-2-(((2R,3S,4R,5R,6R)-6-(((2R,3S,4R,5R,6S)-6-(2-chloro-4-nitrophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
2-Chloro-4-nitrophenyl b-D-maltotrioside
2-Chloro-4-nitrophenyl β-D-maltotrioside
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 976.0±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 149.0±3.0 kJ/mol
    Flash Point: 544.1±34.3 °C
    Index of Refraction: 1.690
    Molar Refractivity: 140.3±0.4 cm3
    #H bond acceptors: 19
    #H bond donors: 10
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 3
    ACD/LogP: -1.25
    ACD/LogD (pH 5.5): -2.32
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.30
    ACD/LogD (pH 7.4): -2.32
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.30
    Polar Surface Area: 304 Å2
    Polarizability: 55.6±0.5 10-24cm3
    Surface Tension: 111.2±5.0 dyne/cm
    Molar Volume: 367.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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