ChemSpider 2D Image | N,N',N''-Tris(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3,5-benzenetricarboxamide | C18H24I3N3O9

N,N',N''-Tris(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3,5-benzenetricarboxamide

  • Molecular FormulaC18H24I3N3O9
  • Average mass807.111 Da
  • Monoisotopic mass806.864624 Da
  • ChemSpider ID8072933

More details:

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

1,3,5-Benzenetricarboxamide, N1,N3,N5-tris(2,3-dihydroxypropyl)-2,4,6-triiodo- [ACD/Index Name]
N,N',N''-Tris(2,3-dihydroxypropyl)-2,4,6-triiod-1,3,5-benzoltricarboxamid [German] [ACD/IUPAC Name]
N,N',N''-Tris(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3,5-benzenetricarboxamide [ACD/IUPAC Name]
N,N',N''-Tris(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3,5-benzènetricarboxamide [French] [ACD/IUPAC Name]
266-164-2 [EINECS]
5-[Acetyl(2,3-dihydroxypropyl)amino]-N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodoisophthalamide [ACD/IUPAC Name]
66108-95-0 [RN]
CZ2205000
Iohexol [BAN] [INN] [JAN] [USAN] [Wiki]
MFCD00077732 [MDL number]

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: 2.2±0.0 g/cm3
    Boiling Point: 820.2±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.0 mmHg at 25°C
    Enthalpy of Vaporization: 125.0±0.0 kJ/mol
    Flash Point: 449.8±0.0 °C
    Index of Refraction: 1.719
    Molar Refractivity: 142.7±0.0 cm3
    #H bond acceptors: 12
    #H bond donors: 9
    #Freely Rotating Bonds: 18
    #Rule of 5 Violations: 3
    ACD/LogP: -4.89
    ACD/LogD (pH 5.5): -4.89
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.89
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 209 Å2
    Polarizability: 56.6±0.0 10-24cm3
    Surface Tension: 86.8±0.0 dyne/cm
    Molar Volume: 361.9±0.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement