Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-kappaO)methyl]amino-kappaN]ethyl]-N-[2-[(S)-[(carboxy-kappaO)methyl](carboxymethyl)amino-kappaN]ethyl]glycinato(5-)-kappaN,kappaO]-, sodium hydrogen (1:1:1), (PB-7-13-12564)-

Base Information

• Chemical Name: Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-kappaO)methyl]amino-kappaN]ethyl]-N-[2-[(S)-[(carboxy-kappaO)methyl](carboxymethyl)amino-kappaN]ethyl]glycinato(5-)-kappaN,kappaO]-, sodium hydrogen (1:1:1), (PB-7-13-12564)-
• CAS No.: 12389-75-2
• Molecular Formula: C14H19FeN3NaO10
• Molecular Weight: 468.15
• European Community (EC) Number: 235-627-0
• DSSTox Substance ID: DTXSID0065305
• Mol file: 12389-75-2.mol

Synonyms:12389-75-2;EINECS 235-627-0;Sodium hydrogen ferric diethylenetriaminepentacetate;EC 235-627-0;C14H18FeN3O10.H.Na;Ferrate(2-), (rel-(N(R))-N-(2-(bis((carboxy-kappaO)methyl)amino-kappaN)ethyl)-N-(2-((S)-((carboxy-kappaO)methyl)(carboxymethyl)amino-kappaN)ethyl)glycinato(5-)-kappaN,kappaO)-, sodium hydrogen, (PB-7-13-12564)-;Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-.kappa.O)methyl]amino-.kappa.N]ethyl]-N-[2-[(S)-[(carboxy-.kappa.O)methyl](carboxymethyl)amino-.kappa.N]ethyl]glycinato(5-)-.kappa.N,.kappa.O]-, sodium hydrogen (1:1:1), (PB-7-13-12564)-;SODIUM HYDROGEN FERRIC DTPA;C14-H18-Fe-N3-O10.H.Na;Ferrate(2-), [N,N-bis[2-[bis(carboxymethyl) amino]ethyl]glycinato(5-)]-, sodium hydrogen, (PB-7-13-12564)-;Ferrate(2-), (N,N-bis(2-(bis(carboxymethyl)amino)ethyl)glycinato(5-))-, sodium hydrogen, (PB-7-13-12564)-;Ferrate(2-), [N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycinato(5-)]-, sodium hydrogen, (PB-7-13-12564)-;Ferrate(2-), [N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycinato(5-)]-, sodium hydrogen;Sodium hydrogen (N,N-bis(2-(bis(carboxymethyl)amino)ethyl)glycinato(5-))ferrate(2-);sodium hydrogen [N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycinato(5-)]ferrate(2-);FERRATE(2-), [N,N-BIS[2-[BIS(CARBOXYMETHYL)AMINO] ETHYL]GLYCINATO(5-)]-, SODIUM HYDROGEN;Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-.kappa.O)methyl]amino-.kappa.N]ethyl]-N-[2-[(S)-[(carboxy-.kappa.O)methyl](carboxymethyl)amino-.kappa.N]ethyl]glycinato(5-)-.kappa.N,.kappa.O]-, sodium hydr;Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-.kappa.O)methyl]amino-.kappa.N]ethyl]-N-[2-[(S)-[(carboxy-.kappa.O)methyl](carboxymethyl)amino-.kappa.N]ethyl]glycinato(5-)-.kappa.N,.kappa.O]-, sodium hydrogen, (PB-7-13-12564)-;DTXSID0065305;AKOS015906975;CS-0442858;FT-0689190;E79249;Ferrate(2-), (rel-(N(R))-N-(2-(bis((carboxy-kappaO)methyl)amino-kappaN)ethyl)-N-(2-((S)-((carboxy-kappaO)methyl)(carboxymethyl)amino-kappaN)ethyl)glycinato(5-)-kappaN,kappaO)-, sodium hydrogen (1:1:1), (PB-7-13-12564)-;Iron(III) sodium 2,2'-((2-((carboxylatomethyl)(2-((carboxylatomethyl)(carboxymethyl)amino)ethyl)amino)ethyl)azanediyl)diacetate

Chemical Property of Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-kappaO)methyl]amino-kappaN]ethyl]-N-[2-[(S)-[(carboxy-kappaO)methyl](carboxymethyl)amino-kappaN]ethyl]glycinato(5-)-kappaN,kappaO]-, sodium hydrogen (1:1:1), (PB-7-13-12564)-

Chemical Property:

• Vapor Pressure: 9.53E-23mmHg at 25°C
• Boiling Point: 721.1 °C at 760 mmHg
• Flash Point: 389.9 °C
• PSA: 166.05000
• Density: 1.607[at 20℃]
• LogP: -4.43940
• Water Solubility.: 113g/L at 30℃
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 12
• Exact Mass: 468.031749
• Heavy Atom Count: 29
• Complexity: 515

Purity/Quality:

11% ^*data from raw suppliers

SodiumHydrogenFerricDTPA ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CN(CC(=O)O)CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3]