CAS 1445950-96-8

rel-1,1-Dimethylethyl (3aR,6aR)-hexahydro-3a-(hydroxymethyl)pyrrolo[3,4-c]pyrrole-2(1H)-carboxylate

Description:

Rel-1,1-Dimethylethyl (3aR,6aR)-hexahydro-3a-(hydroxymethyl)pyrrolo[3,4-c]pyrrole-2(1H)-carboxylate, with CAS number 1445950-96-8, is a chemical compound characterized by its complex bicyclic structure, which includes a pyrrole moiety. This compound features a carboxylate functional group, contributing to its potential reactivity and solubility in various solvents. The presence of a hydroxymethyl group enhances its polarity and may influence its biological activity. The stereochemistry indicated by the (3aR,6aR) configuration suggests specific spatial arrangements of atoms, which can significantly affect the compound's interactions with biological targets. Additionally, the dimethylethyl substituent may impart steric hindrance, influencing the compound's overall reactivity and stability. Such characteristics make it of interest in medicinal chemistry and drug design, where structural modifications can lead to variations in pharmacological properties. Overall, this compound exemplifies the intricate relationship between molecular structure and function in organic chemistry.

Formula: C₁₂H₂₂N₂O₃

InChI: InChI=1/C12H22N2O3/c1-11(2,3)17-10(16)14-5-9-4-13-6-12(9,7-14)8-15/h9,13,15H,4-8H2,1-3H3/t9-,12+/s2

InChI key: InChIKey=BIZOYMDQUKYUEW-JVMLCUHDNA-N

SMILES: C(O)[C@]12[C@](CN(C(OC(C)(C)C)=O)C1)(CNC2)[H]

Synonyms:

• Pyrrolo[3,4-c]pyrrole-2(1H)-carboxylic acid, hexahydro-3a-(hydroxymethyl)-, 1,1-dimethylethyl ester, (3aR,6aR)-rel-
• rel-1,1-Dimethylethyl (3aR,6aR)-hexahydro-3a-(hydroxymethyl)pyrrolo[3,4-c]pyrrole-2(1H)-carboxylate

(3aS,6aS)-tert-Butyl 3a-(hydroxymethyl)hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxylate

CAS: 1445950-96-8

Purity: 98%

Molecular weight: 242.3190002

Ref: 10-F608290