isopropyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate

Base Information

• Chemical Name: isopropyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
• CAS No.: 101855-37-2
• Molecular Formula: C13H13NO4
• Molecular Weight: 247.251
• NSC Number: 117463
• DSSTox Substance ID: DTXSID00297711
• Wikidata: Q82039012
• ChEMBL ID: CHEMBL1529245
• Mol file: 101855-37-2.mol

Synonyms:101855-37-2;STK267882;NSC117463;Oprea1_481509;MLS000113568;CHEMBL1529245;DTXSID00297711;HMS2156F24;HMS3312H01;isopropyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate;AKOS001600265;NSC-117463;SMR000109465;EU-0034829;Isopropyl 2-(1,3-dioxoisoindolin-2-yl)acetate;SR-01000400720;SR-01000400720-1;propan-2-yl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate;propan-2-yl 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetate

Chemical Property of isopropyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 247.08445790
• Heavy Atom Count: 18
• Complexity: 353

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC(=O)CN1C(=O)C2=CC=CC=C2C1=O

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