CAS 873945-29-0

3-Pyrrolidinol, 1-(3-fluorophenyl)-, 3-(4-methylbenzenesulfonate), (3R)-

Description:

3-Pyrrolidinol, 1-(3-fluorophenyl)-, 3-(4-methylbenzenesulfonate), (3R)- is a chemical compound characterized by its pyrrolidine ring structure, which is a five-membered nitrogen-containing heterocycle. The compound features a fluorophenyl group at one position and a sulfonate group derived from 4-methylbenzenesulfonic acid at another position, contributing to its potential as a pharmacological agent. The (3R) designation indicates the specific stereochemistry at the chiral center, which can significantly influence the compound's biological activity and interactions. This substance may exhibit properties such as solubility in organic solvents and potential reactivity due to the presence of the sulfonate group, which can participate in nucleophilic substitution reactions. Its fluorine atom may enhance lipophilicity and metabolic stability, making it of interest in medicinal chemistry. As with many compounds, safety and handling precautions should be observed, as the biological effects and toxicity profiles would need to be evaluated in the context of its intended use.

Formula: C₁₇H₁₈FNO₃S

InChI: InChI=1S/C17H18FNO3S/c1-13-5-7-17(8-6-13)23(20,21)22-16-9-10-19(12-16)15-4-2-3-14(18)11-15/h2-8,11,16H,9-10,12H2,1H3/t16-/m1/s1

InChI key: InChIKey=WRHAQERSQQIYES-MRXNPFEDSA-N

SMILES: O(S(=O)(=O)C1=CC=C(C)C=C1)[C@H]2CN(CC2)C3=CC(F)=CC=C3

Synonyms:

• (R)-1-(3-Fluorophenyl)pyrrolidin-3-yl 4-methylbenzenesulfonate
• 3-Pyrrolidinol, 1-(3-fluorophenyl)-, 4-methylbenzenesulfonate (ester), (3R)-
• 3-Pyrrolidinol,1-(3-fluorophenyl)-, 4-methylbenzenesulfonate (ester), (3R)- (9CI)
• 3-Pyrrolidinol, 1-(3-Fluorophenyl)-, 3-(4-Methylbenzenesulfonate), (3R)-
• 3-Pyrrolidinol, 1-(3-fluorophenyl)-, 3-(4-methylbenzenesulfonate), (3R)-

(R)-1-(3-Fluorophenyl)pyrrolidin-3-yl 4-methylbenzenesulfonate

CAS: 873945-29-0

Formula: C₁₇H₁₈FNO₃S

Molecular weight: 335.3931

Ref: IN-DA004GPL