Deferasirox ferrate(iii)tripotassium complex methanoate hydrate

CAS
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CAS
554445-58-8
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Purity
96%
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Catalog Number

ACM554445588

Product Name

Deferasirox ferrate(iii)tripotassium complex methanoate hydrate

Structure

CAS

554445-58-8

Category

Heterocyclic Organic Compound

Synonyms

(OC-6-22')-Bis[4-[3,5-bis[2-(hydroxy-kO)phenyl]-1H-1,2,4-triazol-1-yl-kN4]benzoato(3-)]ferrate(3-) Tripotassium Methanoate Hydrate;

IUPAC Name

tripotassium;4-[(3E,5E)-3,5-bis(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,4-triazolidin-1-yl]benzoate;iron;methanol;dihydrate

Molecular Weight

1013.93

Molecular Formula

C₄₄H₃₆FeK₃N₆O₁₂

Canonical SMILES

CO.CO.C1=CC(=C2NC(=C3C=CC=CC3=O)N(N2)C4=CC=C(C=C4)C(=O)[O-])C(=O)C=C1.C1=CC(=C2NC(=C3C=CC=CC3=O)N(N2)C4=CC=C(C=C4)C(=O)[O-])C(=O)C=C1.O.O.[K+].[K+].[K+].[Fe]

InChI Key

BZELUNNKEIJFGM-WLENEYSGSA-L

Exact Mass

1017.10000

H-Bond Acceptor

H-Bond Donor

MSDS

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COA

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Spec Sheet

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