12111-24-9

Name calcium trisodium pentetate
CAS 12111-24-9
EINECS(EC#) 235-169-1
Molecular Formula C25H35CaNa3O10
MDL Number MFCD00066452
Molecular Weight 604.587
MOL File 12111-24-9.mol
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Chemical Properties

storage temp.  2-8°C
Major Application pharmaceutical (small molecule)
InChIKey AYFCVLSUPGCQKD-UHFFFAOYSA-I
SMILES [Ca+2].[Na+].[Na+].[Na+].N(CCN(CC(=O)[O-])CC(=O)[O-])(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-]
EPA Substance Registry System Calciate(3-), [N-[2-[bis[(carboxy-.kappa.O)methyl]amino-.kappa.N]ethyl]-N-[2-[[(carboxy-.kappa.O)methyl](carboxymethyl)amino-.kappa.N]ethyl]glycinato(5-)-.kappa.N]-, sodium (1:3) (12111-24-9)

Safety Data

TSCA  TSCA listed
Safety Profile
Moderately toxic by intravenous and intraperitoneal routes. Experimental teratogenic and reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of NazO and NO,. See also CALCIUM COMPOUNDS.
Toxicity
LD50 i.p. in rats: 3.8 g/kg (Dagirmanjian)

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