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ChemicalBook--->CAS DataBase List--->1061605-21-7

1061605-21-7

1061605-21-7 Structure

1061605-21-7 Structure
IdentificationBack Directory
[Name]

Cereblon Ligand 1
[CAS]

1061605-21-7
[Synonyms]

TC E3 5031
Thalidomide-Acid
Cereblon ligand 3
Cereblon Ligand 1
Thalidomide-O-COOH
Thalidomide-4-hydroxyacetate
Pomalidomide Related Compound 1
2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetic acid
2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)oxy)acetic acid
2-[[2-(2,6-Dioxo-3-piperidinyl)-2,3-dihydro-1,3-dioxo-1H-isoindol-4-yl]oxy]acetic acid
Acetic acid, 2-[[2-(2,6-dioxo-3-piperidinyl)-2,3-dihydro-1,3-dioxo-1H-isoindol-4-yl]oxy]-
[Molecular Formula]

C15H12N2O7
[MDL Number]

MFCD31560477
[MOL File]

1061605-21-7.mol
[Molecular Weight]

332.27
Chemical PropertiesBack Directory
[Boiling point ]

660.5±55.0 °C(Predicted)
[density ]

1.606±0.06 g/cm3(Predicted)
[solubility ]

Soluble in DCM
[form ]

A crystalline solid
[pka]

2.95±0.10(Predicted)
[color ]

White to off-white
[InChI]

InChI=1S/C15H12N2O7/c18-10-5-4-8(13(21)16-10)17-14(22)7-2-1-3-9(12(7)15(17)23)24-6-11(19)20/h1-3,8H,4-6H2,(H,19,20)(H,16,18,21)
[InChIKey]

ZVWIXIGBWIEDFO-UHFFFAOYSA-N
[SMILES]

C(O)(=O)COC1=CC=CC2=C1C(=O)N(C1CCC(=O)NC1=O)C2=O
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933998090
Hazard InformationBack Directory
[Description]

Thalidomide-Acid is a linker of Thalidomide which is commonly used as a precursor to PROTAC that hijacks cereblon as the E3 ubiquitin ligase component.
[Uses]

Thalidomide-4-hydroxyacetate is a proteolysis targeting chimeras which allows for the optical control of protein degradation.
[Solubility in organics]

DMF: 30 mg/ml
DMSO: 30 mg/ml
PBS (pH 7.2): 1 mg/ml
[storage]

Store at RT
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