2,5-Dioxopyrrolidin-1-yl benzoate

C₁₁H₉NO₄CAS 23405-15-4219.20 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₉NO₄
Molar mass: 219.20 g/mol
Exact mass: 219.0532 Da
logP: 0.91Crippen estimate
Polar surface area: 63.7 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 2

Identifiers

CAS number

23405-15-4

SMILES

C1CC(=O)N(C1=O)OC(=O)C2=CC=CC=C2

InChIKey

BVUOEDOMUOJKOY-UHFFFAOYSA-N

InChI

InChI=1S/C11H9NO4/c13-9-6-7-10(14)12(9)16-11(15)8-4-2-1-3-5-8/h1-5H,6-7H2

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Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

Bz-osu

Work with 2,5-Dioxopyrrolidin-1-yl benzoate

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

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

Same formula

1,3-Dihydro-α-methyl-1,3-dioxo-2H-isoindole-2-acetic acid21860-84-4 N-Carbethoxyphthalimide22509-74-6 4-Hydroxy-6-methoxyquinoline-3-carboxylic acid28027-16-9 5-(4-Nitrophenyl)furfuryl alcohol33342-30-2 N-Phthaloyl-β-alanine3339-73-9 Pht-ala-oh4192-28-3

Elsewhere

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