Chromium Cr-51 edetateProduct ingredient for Chromium Cr-51

Name
Chromium Cr-51 edetate
Drug Entry
Chromium Cr-51

Chromium Cr-51 is an isotope of chromium that has been used as a radioactive label for decades. It is used as a diagnostic radiopharmaceutical agent in nephrology to determine glomerular filtration rate,1,2 and in hematology to determine red blood cell volume or mass, study the red blood cell survival time and evaluate blood loss.3,4

Accession Number
DBSALT002477
Structure
Synonyms
Chromium Cr 51 edetate
UNII
N3Y22O955Z
CAS Number
27849-89-4
Weight
Average: 343.189
Monoisotopic: 343.03543725
Chemical Formula
C10H16CrN2O8
InChI Key
YJZDPFHZDKVOTR-HCMAANCNSA-N
InChI
InChI=1S/C10H16N2O8.Cr/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);/i;1-1
IUPAC Name
2-({2-[bis(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetic acid (51Cr)chromium
SMILES
[51Cr].OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O
ChemSpider
30791793
Predicted Properties
PropertyValueSource
Water Solubility9.26 mg/mLALOGPS
logP-1.2ALOGPS
logP-4.9Chemaxon
logS-1.5ALOGPS
pKa (Strongest Acidic)2.35Chemaxon
pKa (Strongest Basic)7.73Chemaxon
Physiological Charge-3Chemaxon
Hydrogen Acceptor Count10Chemaxon
Hydrogen Donor Count4Chemaxon
Polar Surface Area155.68 Å2Chemaxon
Rotatable Bond Count11Chemaxon
Refractivity62.35 m3·mol-1Chemaxon
Polarizability26.08 Å3Chemaxon
Number of Rings0Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon