2-(2,6-Dioxopiperidin-3-yl)-4-fluoroisoindoline-1,3-dione

C₁₃H₉FN₂O₄CAS 835616-60-9276.22 g/mol

Open in Covalent MOL file

Amide Aryl halide Lactam

Properties

Molecular formula: C₁₃H₉FN₂O₄
Molar mass: 276.22 g/mol
Exact mass: 276.0546 Da
logP: 0.23Crippen estimate
Polar surface area: 83.6 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

835616-60-9

SMILES

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)F

InChIKey

CRAUTELYXAAAPW-UHFFFAOYSA-N

InChI

InChI=1S/C13H9FN2O4/c14-7-3-1-2-6-10(7)13(20)16(12(6)19)8-4-5-9(17)15-11(8)18/h1-3,8H,4-5H2,(H,15,17,18)

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Names and synonyms

1 names

1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-4-fluoro-

Work with 2-(2,6-Dioxopiperidin-3-yl)-4-fluoroisoindoline-1,3-dione

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Hydroxy thalidomide5054-59-172 % similar 3-(4-Nitro-1-oxo-1,3-dihydroisoindol-2-yl)piperidine-2,6-dione827026-45-946 % similar 2-(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)pentanedioic acid2301-52-240 % similar N-Phthaloyl-L-glutamic acid340-90-940 % similar Pomalidomide19171-19-840 % similar Thalidomide50-35-136 % similar N-Phthaloyl-L-glutamine3343-29-136 % similar 2-(4-Oxocyclohexyl)-1H-isoindole-1,3(2H)-dione104618-32-834 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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