ChemSpider 2D Image | iotrolan | C37H48I6N6O18

iotrolan

  • Molecular FormulaC37H48I6N6O18
  • Average mass1626.233 Da
  • Monoisotopic mass1625.729248 Da
  • ChemSpider ID3607

More details:

Featured data source
The Merck Index Online

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

1,3-Benzenedicarboxamide, 5,5'-[(1,3-dioxo-1,3-propanediyl)bis(methylimino)]bis[N1,N3-bis[2,3-dihydroxy-1-(hydroxymethyl)propyl]-2,4,6-triiodo- [ACD/Index Name]
5,5'-[(1,3-Dioxo-1,3-propandiyl)bis(methylimino)]bis[2,4,6-triiod-N,N'-bis(1,3,4-trihydroxy-2-butanyl)isophthalamid] [German] [ACD/IUPAC Name]
5,5'-[(1,3-Dioxo-1,3-propanediyl)bis(méthylimino)]bis[2,4,6-triiodo-N,N'-bis(1,3,4-trihydroxy-2-butanyl)isophtalamide] [French] [ACD/IUPAC Name]
5,5'-[(1,3-Dioxo-1,3-propanediyl)bis(methylimino)]bis[2,4,6-triiodo-N,N'-bis(1,3,4-trihydroxy-2-butanyl)isophthalamide] [ACD/IUPAC Name]
5,5'-[(1,3-Dioxo-1,3-propanediyl)bis(methylimino)]bis[N,N'-bis[2,3-dihydroxy-1-(hydroxymethyl)propyl]-2,4,6-triiodo-1,3-benzenedicarboxamide]
5,5'-[(1,3-dioxopropane-1,3-diyl)bis(methylimino)]bis[2,4,6-triiodo-N,N'-bis(1,3,4-trihydroxybutan-2-yl)benzene-1,3-dicarboxamide]
5,5'-[(1,3-Dioxopropane-1,3-diyl)bis(methylimino)]bis[2,4,6-triiodo-N,N'-bis(1,3,4-trihydroxybutan-2-yl)isophthalamide]
5,5'-[(1,3-dioxopropane-1,3-diyl)bis(methylimino)]bis{N,N'-bis[2,3-dihydroxy-1-(hydroxymethyl)propyl]-2,4,6-triiodobenzene-1,3-dicarboxamide}
5,5'-[malonylbis(methylimino)]bis[n,n'-bis[2,3-dihydroxy-1-(hydroxymethyl)propyl]-2,4,6-triiodoisophthalamide]
iotrolan [BAN] [INN] [JAN] [USAN] [Wiki]
More...

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

DL 3117 [DBID]
UNII:16FL47B687 [DBID]
D01714 [DBID]
DL-3117 [DBID]
SH 437 [DBID]
SH-L-437D [DBID]
UNII-16FL47B687 [DBID]
ZK 39482 [DBID]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 1390.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 221.0±3.0 kJ/mol
Flash Point: 794.7±34.3 °C
Index of Refraction: 1.762
Molar Refractivity: 289.4±0.3 cm3
#H bond acceptors: 24
#H bond donors: 16
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 3
ACD/LogP: -5.21
ACD/LogD (pH 5.5): -4.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 400 Å2
Polarizability: 114.7±0.5 10-24cm3
Surface Tension: 96.4±3.0 dyne/cm
Molar Volume: 702.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement