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ChemicalBook--->CAS DataBase List--->1222468-90-7

1222468-90-7

1222468-90-7 Structure

1222468-90-7 Structure
IdentificationBack Directory
[Name]

p-NCS-Bz-DFO
[CAS]

1222468-90-7
[Synonyms]

p-NCS-Bz-DFO
p-SCN-Bn-Deferoxamine
p-SCN-Bn-Deferoxamine,p-NCS-Bz-DFO
2-[1, 4, 7-Triazacyclononan-1-yl-4, 7-bis(tBu-ester)1-1, 5-pentanedioic acid
Butanediamide, N4-[5-[[4-[[5-(acetylhydroxyamino)pentyl]amino]-1,4-dioxobutyl]hydroxyamino]pentyl]-N1-hydroxy-N1-[5-[[[(4-isothiocyanatophenyl)amino]thioxomethyl]amino]pentyl]-
[Molecular Formula]

C33H52N8O8S2
[MOL File]

1222468-90-7.mol
[Molecular Weight]

752.94
Chemical PropertiesBack Directory
[Melting point ]

174° - 175°
[storage temp. ]

Hygroscopic, -20°C Freezer, Under inert atmosphere
[solubility ]

Acetonitrile (Slightly, Heated), DMSO (Slightly, Heated), Methanol (Slightly)
[form ]

Solid
[color ]

White to Off-White
[Stability:]

Hygroscopic
[InChIKey]

HBAYEVATSBINBX-UHFFFAOYSA-N
[SMILES]

C(N(O)CCCCCNC(NC1=CC=C(N=C=S)C=C1)=S)(=O)CCC(NCCCCCN(C(=O)CCC(NCCCCCN(C(C)=O)O)=O)O)=O
Hazard InformationBack Directory
[Uses]

p-SCN-Bn-deferoxamine, is a bifunctional chelator.
[IC 50]

RDC Linker
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