ChemSpider 2D Image | 2-(3-{[N-Ethyl-N-(2-hydroxyethyl)glycyl]amino}-2,4,6-triiodobenzyl)butanoic acid | C17H23I3N2O4

2-(3-{[N-Ethyl-N-(2-hydroxyethyl)glycyl]amino}-2,4,6-triiodobenzyl)butanoic acid

  • Molecular FormulaC17H23I3N2O4
  • Average mass700.089 Da
  • Monoisotopic mass699.879150 Da
  • ChemSpider ID116389

More details:

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

2-(3-{[N-Ethyl-N-(2-hydroxyethyl)glycyl]amino}-2,4,6-triiodbenzyl)butansäure [German] [ACD/IUPAC Name]
2-(3-{[N-Ethyl-N-(2-hydroxyethyl)glycyl]amino}-2,4,6-triiodobenzyl)butanoic acid [ACD/IUPAC Name]
Acide 2-(3-{[N-éthyl-N-(2-hydroxyéthyl)glycyl]amino}-2,4,6-triiodobenzyl)butanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, α-ethyl-3-[[2-[ethyl(2-hydroxyethyl)amino]acetyl]amino]-2,4,6-triiodo- [ACD/Index Name]
2-(3-(N-Ethyl-2-hydroxyethyl)amino-acetamido-2,4,6-triiodobenzyl)-butyric acid
2-(3-(N-ETHYL-2-HYDROXYETHYL)AMINOACETAMIDO-2,4,6-TRIIODOBENZYL)BUTYRIC ACID
2-[[3-[[2-(ethyl-(2-hydroxyethyl)amino)acetyl]amino]-2,4,6-triiodophenyl]methyl]butanoic acid
76975-06-9 [RN]
Benzenepropanoic acid, α-ethyl-3-((ethyl(2-hydroxyethyl)amino)acetylamino)-2,4,6-triiodo-
Hydrocinnamic acid, α-ethyl-3-(2-(ethyl(2-hydroxyethyl)amino)acetamido)-2,4,6-triiodo-

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

RCK-136 [DBID]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 679.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.7±3.0 kJ/mol
Flash Point: 364.5±31.5 °C
Index of Refraction: 1.685
Molar Refractivity: 128.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 1.30
ACD/BCF (pH 5.5): 2.02
ACD/KOC (pH 5.5): 16.79
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.11
Polar Surface Area: 90 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 64.5±3.0 dyne/cm
Molar Volume: 336.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement