Methyl 5-(2-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Base Information

• Chemical Name: Methyl 5-(2-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
• CAS No.: 5633-84-1
• Molecular Formula: C14H13N3O4
• Molecular Weight: 287.27
• DSSTox Substance ID: DTXSID90386269

Synonyms:5633-84-1;methyl 5-(2-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate;methyl 5-(2-methylphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate;CBMicro_026642;ChemDiv1_022235;HMS650C15;DTXSID90386269;IIIAVTLDDGZKOM-UHFFFAOYSA-N;STK710073;AKOS000478402;AKOS024274813;CCG-107254;4,6-Dioxo-5-o-tolyl-1,3a,4,5,6,6a-hexahydro-pyrrolo[3,4-c]pyrazole-3-carboxylic;BIM-0026691.P001;AG-205/36953278;SR-01000440816;SR-01000440816-1

Chemical Property of Methyl 5-(2-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Chemical Property:

• Vapor Pressure: 2.1E-11mmHg at 25°C
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 287.09060590
• Heavy Atom Count: 21
• Complexity: 530

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=CC=C1N2C(=O)C3C(C2=O)NN=C3C(=O)OC

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