4-(4-ethoxy-3-methylbenzoyl)-1-(3-ethoxypropyl)-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one

Base Information

• Chemical Name: 4-(4-ethoxy-3-methylbenzoyl)-1-(3-ethoxypropyl)-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one
• CAS No.: 617694-22-1
• Molecular Formula: C26H31NO5
• Molecular Weight: 437.5
• European Community (EC) Number: 646-236-3
• Mol file: 617694-22-1.mol

Synonyms:4-(4-ethoxy-3-methylbenzoyl)-1-(3-ethoxypropyl)-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one;617694-22-1;4-(4-Ethoxy-3-methylbenzoyl)-1-(3-ethoxypropyl)-3-hydroxy-5-(p-tolyl)-1H-pyrrol-2(5H)-one;RCWPSTBWUZGDRM-ZNTNEXAZSA-N;STK880645;AKOS002194659;AKOS016067950;(4E)-4-[(4-ethoxy-3-methylphenyl)-hydroxymethylidene]-1-(3-ethoxypropyl)-5-(4-methylphenyl)pyrrolidine-2,3-dione;AF-399/41898861;Z57782439;4-[(4-ethoxy-3-methylphenyl)carbonyl]-1-(3-ethoxypropyl)-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one

Chemical Property of 4-(4-ethoxy-3-methylbenzoyl)-1-(3-ethoxypropyl)-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one

Chemical Property:

• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 437.22022309
• Heavy Atom Count: 32
• Complexity: 682

Purity/Quality:

4-(4-ETHOXY-3-METHYLBENZOYL)-1-(3-ETHOXYPROPYL)-3-HYDROXY-5-(4-METHYLPHENYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE 95.00% ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCOCCCN1C(C(=C(C2=CC(=C(C=C2)OCC)C)O)C(=O)C1=O)C3=CC=C(C=C3)C
• Isomeric SMILES: CCOCCCN1C(/C(=C(/C2=CC(=C(C=C2)OCC)C)\O)/C(=O)C1=O)C3=CC=C(C=C3)C