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(3R,5S)-5-(Hydroxymethyl)pyrrolidin-3-ol hydrochloride

  • CAS No. 478922-47-3

  • Cat. No. CS-0043961
  • Purity≥97%
  • MDL No.MFCD09056830

*For research and further manufacturing use only, not for direct human use.

(3R,5S)-5-(Hydroxymethyl)pyrrolidin-3-ol hydrochloride|CS-0043961

Structure of 478922-47-3

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General Information

  • CAS No. 478922-47-3
  • Cat. No. CS-0043961
  • Purity ≥97%
  • MDL No. MFCD09056830
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₁₂ClNO₂
  • Molecular Weight 153.61
  • Synonym(s) (3R,5S)-5-Hydroxymethyl-3-pyrrolidinol Hydrochloride
  • SMILES O[C@H]1CN[C@@H](C1)CO.[H]Cl

Description

This chiral pyrrolidine derivative features a hydroxymethyl group at the 5-position and a hydroxyl substituent at the 3-position, delivering enhanced solubility and metabolic stability. The hydrochloride salt form ensures improved crystallinity and handling convenience. This scaffold serves as a key building block in medicinal chemistry, particularly for targeted kinase inhibitors and CNS-active compounds.

Application

(3R,5S)-5-(Hydroxymethyl)pyrrolidin-3-ol hydrochloride serves as a stereochemically defined pyrrolidine scaffold with orthogonal functional handles: a secondary alcohol and a primary aliphatic amine. The hydrochloride salt enhances solubility and stability in aqueous and polar organic media, enabling straightforward handling and purification. It functions as a versatile building block for medicinal chemistry campaigns, facilitating late-stage derivatization via reductive amination, esterification, or coupling reactions. Its well-defined stereochemistry supports consistent biological evaluation in target-directed synthesis.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   52.49
  • LogP   -0.8767
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   1

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