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3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- structure
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3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-

TL;DR: 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- (CAS 105991-69-3) is a chemical compound with molecular formula C5H11NO3 and molecular weight 133.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2R,3R,4S)-2-(hydroxymethyl)pyrrolidine-3,4-diol

Also Known As: IMINORIBITOL, DRib, 1,4-Dideoxy-1,4-imino-D-ribitol, (2R,3R,4S)-2-(hydroxymethyl)pyrrolidine-3,4-diol, 1,4-Imino-1,4-dideoxy-D-ribitol

CAS Number
105991-69-3
Molecular Formula
C5H11NO3
Molecular Weight
133.0739 g/mol
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Application Areas

Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (8 patents) Biotechnology (5 patents) Heterocyclic Building Blocks (66 patents) Organic Building Blocks (18 patents) Organometallic Reagents (2 patents)

Technical Specifications

Molecular FormulaC5H11NO3
Molecular Weight133.0739 g/mol
XLogP-1.7
Topological Polar Surface Area (TPSA)72.7 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass133.0739 Da
Heavy Atoms9
Complexity98.0
SMILESC1[C@@H]([C@@H]([C@H](N1)CO)O)O
InChIKeyOQEBIHBLFRADNM-MROZADKFSA-N

Chemical Property Profile of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-

XLogP
-1.7
TPSA (Topological Polar Surface Area)
72.7
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
9
Complexity
98.0
Exact Mass
133.0739
Monoisotopic Mass
133.0739
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-

The XLogP value of -1.7 indicates that 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-. Following Lipinski's Rule of Five, 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-?

The CAS number of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- is 105991-69-3.

What is the molecular formula of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-?

The molecular formula of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- is C5H11NO3.

What is the molecular weight of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-?

The molecular weight of 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- is 133.0739 g/mol.

Where can I buy 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-?

You can request a quote for 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)-?

Yes, CoreyChem provides custom synthesis services for 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, (2R,3R,4S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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