cis-2-Methylhexahydropyrrolo[3,4-C]pyrrole

Base Information

• Chemical Name: cis-2-Methylhexahydropyrrolo[3,4-C]pyrrole
• CAS No.: 172739-03-6
• Molecular Formula: C7H14 N2
• Molecular Weight: 126.202
• Hs Code.: 2921309990
• European Community (EC) Number: 819-999-7
• DSSTox Substance ID: DTXSID20514018
• Wikidata: Q76422987
• Mol file: 172739-03-6.mol

Synonyms:172739-03-6;CIS-2-METHYLHEXAHYDROPYRROLO[3,4-C]PYRROLE;(3aR,6aS)-2-Methyloctahydropyrrolo[3,4-c]pyrrole;cis-2-Methyloctahydropyrrolo[3,4-c]pyrrole;Pyrrolo[3,4-c]pyrrole, octahydro-2-methyl-, cis-;Pyrrolo[3,4-c]pyrrole, octahydro-2-methyl-, cis- (9CI);(3aR,6aS)-5-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;MFCD12198835;cis-2-Methyl-octahydro-pyrrolo[3,4-c]pyrrole;cis-octahydro-2-methyl-Pyrrolo[3,4-c]pyrrole;SCHEMBL1394033;rac-(3aR,6aS)-2-methyloctahydropyrrolo[3,4-c]pyrrole;DTXSID20514018;YQURLNGUWNDBIR-KNVOCYPGSA-N;XGA73903;AKOS006359659;AM81158;AS-31809;CS-0007557;(cis)-octahydro-2-methylpyrrolo[3,4-c]pyrrole;EN300-187369;A881848;(3aR,6aS)-2-methyl-octahydropyrrolo[3,4-c]pyrrole;cis-2-Methylhexahydropyrrolo[3 pound not4-c]pyrrole;Z1947775299

Chemical Property of cis-2-Methylhexahydropyrrolo[3,4-C]pyrrole

Chemical Property:

• Boiling Point: 181.5±8.0 °C(Predicted)
• PKA: 10.90±0.20(Predicted)
• PSA: 15.27000
• Density: 0.970±0.06 g/cm3(Predicted)
• LogP: 0.03410
• Storage Temp.: 2-8°C
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 126.115698455
• Heavy Atom Count: 9
• Complexity: 102

Purity/Quality:

97% ^*data from raw suppliers

cis-2-Methylhexahydropyrrolo[3,4-c]pyrrole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC2CNCC2C1
• Isomeric SMILES: CN1C[C@H]2CNC[C@H]2C1
• Uses: cis-2-Methylhexahydropyrrolo[3,4-c]pyrrole is used as a reagent in the synthesis of novel aryl substituted urea derivatives which can exhibit antimicrobial activity against pathogenic bacteria and fungi. It is also used in the preparation of 3-hydroxyquinazoline-2,4-dione antibacterial agents.

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