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26166-92-7

26166-92-7 Structure

26166-92-7 Structure
IdentificationBack Directory
[Name]

5-bromo-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione
[CAS]

26166-92-7
[Synonyms]

135586
5-bromo-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione
1H-Isoindole-1,3(2H)-dione, 5-bromo-2-(2,6-dioxo-3-piperidinyl)-
5-bromo-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione(WXC07613)
5-bromo-2-(2,6-dioxopiperidin-3-yl)-2,3-dihydro-1 H-isoindole-1,3-dione
[Molecular Formula]

C13H9BrN2O4
[MDL Number]

MFCD30188073
[MOL File]

26166-92-7.mol
[Molecular Weight]

337.13
Chemical PropertiesBack Directory
[Melting point ]

>230 °C
[Boiling point ]

564.3±45.0 °C(Predicted)
[density ]

1.794±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

Solid
[pka]

10.60±0.40(Predicted)
[color ]

Off-white to gray
[InChI]

InChI=1S/C13H9BrN2O4/c14-6-1-2-7-8(5-6)13(20)16(12(7)19)9-3-4-10(17)15-11(9)18/h1-2,5,9H,3-4H2,(H,15,17,18)
[InChIKey]

MWMSBQXTHIEBNT-UHFFFAOYSA-N
[SMILES]

C1(=O)C2=C(C=C(Br)C=C2)C(=O)N1C1CCC(=O)NC1=O
Hazard InformationBack Directory
[Description]

5-Bromo-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione is a derivative of thalidomide with an bromide atom on the benzyl ring
[Chemical Properties]

White to Light gray to Light yellow powder to crystal
[Uses]

Thalidomide-5-Br (compound 4) is a compound with a bromodomain. Thalidomide-5-Br can be used in the research of inflammation, tumor and neurology[1].
[References]

[1] Yeung, et al. "Novel thalidomide analogues with potent NFκB and TNF expression inhibition." MedChemComm 2.11 (2011): 1073-1078.
Spectrum DetailBack Directory
[Spectrum Detail]

5-Bromo-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione(26166-92-7)1HNMR
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