ChemSpider 2D Image | N,N'-Bis[(2S)-2,3-dihydroxypropyl]-2,4,6-triiodo-5-[(methoxyacetyl)amino]-N-methylisophthalamide | C18H24I3N3O8

N,N'-Bis[(2S)-2,3-dihydroxypropyl]-2,4,6-triiodo-5-[(methoxyacetyl)amino]-N-methylisophthalamide

  • Molecular FormulaC18H24I3N3O8
  • Average mass791.112 Da
  • Monoisotopic mass790.869690 Da
  • ChemSpider ID34986720

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,3-Benzenedicarboxamide, N1,N3-bis[(2S)-2,3-dihydroxypropyl]-2,4,6-triiodo-5-[(2-methoxyacetyl)amino]-N1-methyl- [ACD/Index Name]
73334-07-3 [RN]
N,N'-Bis[(2S)-2,3-dihydroxypropyl]-2,4,6-triiod-5-[(methoxyacetyl)amino]-N-methylisophthalamid [German] [ACD/IUPAC Name]
N,N'-Bis[(2S)-2,3-dihydroxypropyl]-2,4,6-triiodo-5-[(2-méthoxyacétyl)amino]-N-méthylisophtalamide [French] [ACD/IUPAC Name]
N,N'-Bis[(2S)-2,3-dihydroxypropyl]-2,4,6-triiodo-5-[(methoxyacetyl)amino]-N-methylisophthalamide [ACD/IUPAC Name]
N1,N3-bis[(2S)-2,3-dihydroxypropyl]-2,4,6-triiodo-5-(2-methoxyacetamido)-N1-methylbenzene-1,3-dicarboxamide
277-385-9 [EINECS]
CAS-73334-07-3
iopromide [INN] [Wiki]
N,N'-bis[(2R)-2,3-dihydroxypropyl]-2,4,6-triiodo-5-(2-methoxyethanoylamino)-N'-methyl-benzene-1,3-dicarboxamide
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

NCGC00016923-01 [DBID]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 840.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 128.1±3.0 kJ/mol
Flash Point: 462.4±34.3 °C
Index of Refraction: 1.710
Molar Refractivity: 142.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -2.95
ACD/LogD (pH 5.5): -2.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.67
ACD/LogD (pH 7.4): -2.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.67
Polar Surface Area: 169 Å2
Polarizability: 56.4±0.5 10-24cm3
Surface Tension: 78.0±3.0 dyne/cm
Molar Volume: 364.0±3.0 cm3

Click to predict properties on the Chemicalize site


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