CAS 887590-81-0

1,1-Dimethylethyl 3-[[[(3-bromophenyl)methyl]amino]methyl]-1-pyrrolidinecarboxylate

Description:

1,1-Dimethylethyl 3-[[[(3-bromophenyl)methyl]amino]methyl]-1-pyrrolidinecarboxylate, identified by its CAS number 887590-81-0, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring and a carboxylate functional group. This compound features a tert-butyl group (1,1-dimethylethyl) that contributes to its steric bulk, potentially influencing its reactivity and interactions. The presence of a bromophenyl moiety suggests that it may exhibit unique electronic properties due to the bromine substituent, which can affect the compound's polarity and solubility. The amino group in the structure indicates potential for hydrogen bonding and reactivity in biological systems, making it of interest in medicinal chemistry. Overall, the compound's characteristics, including its molecular weight, solubility, and stability, would be influenced by its specific functional groups and overall molecular architecture, which could be relevant for applications in pharmaceuticals or agrochemicals. Further studies would be necessary to elucidate its full chemical behavior and potential applications.

Formula: C₁₇H₂₅BrN₂O₂

InChI: InChI=1S/C17H25BrN2O2/c1-17(2,3)22-16(21)20-8-7-14(12-20)11-19-10-13-5-4-6-15(18)9-13/h4-6,9,14,19H,7-8,10-12H2,1-3H3

InChI key: InChIKey=SUGRDCYKGDSWBM-UHFFFAOYSA-N

SMILES: C(OC(C)(C)C)(=O)N1CC(CNCC2=CC(Br)=CC=C2)CC1

Synonyms:

• 1-Pyrrolidinecarboxylic acid, 3-[[[(3-bromophenyl)methyl]amino]methyl]-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 3-[[[(3-bromophenyl)methyl]amino]methyl]-1-pyrrolidinecarboxylate

1-Pyrrolidinecarboxylicacid, 3-[[[(3-bromophenyl)methyl]amino]methyl]-, 1,1-dimethylethyl ester

CAS: 887590-81-0

Formula: C₁₇H₂₅BrN₂O₂

Molecular weight: 369.2966

Ref: IN-DA004DEF