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127000-20-8

127000-20-8 structural image
Product Name: GADOBENATE DIMEGLUMINE
Formula: C29H44GdN4O16-
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Hygroscopic powder
Melting Point 124 °C
Solubility Freely soluble in water
Density 1.22 g/mL at 20 °C
Optical Rotation Specific optical rotation: -26.9 deg at 20 °C/365 °C (c = 1.45 in water)
Viscosity 9.2 mPa.sec at 20 °C; 5.3 mPa.sec at 37 °C
Other Experimental Properties Supplied as a sterile, non-pyrogenic, clear, colorless aqueous solution /Multihance/

COMPUTED DESCRIPTORS

Molecular Weight 513.5 g/mol
XLogP3 -7.1
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 20
Exact Mass 513.19585881 g/mol
Monoisotopic Mass 513.19585881 g/mol
Topological Polar Surface Area 205 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 727
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Gadobenate Dimeglumine is a gadolinium-based paramagnetic contrast agent. When placed in a magnetic field, gadobenate dimeglumine produces a large magnetic moment and so a large local magnetic field, which can enhance the relaxation rate of nearby protons; as a result, the signal intensity of tissue images observed with magnetic resonance imaging (MRI) may be enhanced. Because this agent is preferentially taken up by normal functioning hepatocytes, normal hepatic tissue is enhanced with MRI while tumor tissue is unenhanced. In addition, because gadobenate dimeglumine is excreted in the bile, it may be used to visualize the biliary system using MRI.