ChemicalBook--->CAS DataBase List--->1402393-59-2

1402393-59-2

1402393-59-2 Structure

1402393-59-2 Structure
IdentificationBack Directory
[Name]

4-Aminobutyl-DOTA-tris(t-butyl ester)
[CAS]

1402393-59-2
[Synonyms]

DOTA-(COOt-Bu)3-C4-NH2
Gadobutrol Impurity 96
Aminobutyl-DOTA-tris(t-butyl ester)
4-Aminobutyl-DOTA-tris(t-butyl ester)
Tri-tert-butyl 2,2',2''-(10-(2-((4-aminobutyl)amino)-2-oxoethyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate
Tri-tert-butyl 2,2',2''-(10-(2-((4-aminobutyl)amino)-2-oxoethyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate
tert-butyl 2-(4-{[(4-aminobutyl)carbamoyl]methyl}-7,10-bis[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecan-1-yl)acetate
1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic acid, 10-[2-[(4-aminobutyl)amino]-2-oxoethyl]-, 1,4,7-tris(1,1-dimethylethyl) ester
[Molecular Formula]

C32H62N6O7
[MDL Number]

MFCD34598711
[MOL File]

1402393-59-2.mol
[Molecular Weight]

642.87
Chemical PropertiesBack Directory
[Boiling point ]

710.0±60.0 °C(Predicted)
[density ]

1.050±0.06 g/cm3(Predicted)
[solubility ]

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

Solid
[pka]

16.01±0.46(Predicted)
[color ]

White to Off-White
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Hazard InformationBack Directory
[Uses]

4-Aminobutyl-DOTA-tris (t-butyl ester), is a bifunctional chelator.
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