1,4-dideoxy-1,4-imino-L-xylitol
TL;DR: 1,4-dideoxy-1,4-imino-L-xylitol (CAS 100937-53-9) is a chemical compound with molecular formula C5H11NO3 and molecular weight 133.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4R)-2-(hydroxymethyl)pyrrolidine-3,4-diol
Also Known As: 1,4-dideoxy-1,4-imino-l-xylitol, 1,4-dideoxy -1,4-imino-L-xylitol, 1,4-Imino-1,4-dideoxy-L-xylitol, (2S,3R,4R)-2-(hydroxymethyl)pyrrolidine-3,4-diol, 2beta-(Hydroxymethyl)pyrrolidine-3beta,4alpha-diol
| Molecular Formula | C5H11NO3 |
|---|---|
| Molecular Weight | 133.07 g/mol |
| LogP | -2.3277 |
| Topological Polar Surface Area | 72.72 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.0739 |
| Heavy Atoms | 9 |
| Complexity | 98.203896 |
Chemical Identifiers
| CAS Number | 100937-53-9 |
|---|---|
| SMILES | C1[C@H]([C@@H]([C@@H](N1)CO)O)O |
Product Overview
1,4-dideoxy-1,4-imino-L-xylitol (CAS 100937-53-9), with molecular formula C5H11NO3 and molecular weight 133.07 g/mol. IUPAC: (2S,3R,4R)-2-(hydroxymethyl)pyrrolidine-3,4-diol.
Chemical Property Profile of 1,4-dideoxy-1,4-imino-L-xylitol
Property Insights of 1,4-dideoxy-1,4-imino-L-xylitol
The XLogP value of -2.3277 indicates that 1,4-dideoxy-1,4-imino-L-xylitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-dideoxy-1,4-imino-L-xylitol. Following Lipinski's Rule of Five, 1,4-dideoxy-1,4-imino-L-xylitol 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
Frequently Asked Questions
What is the CAS number of 1,4-dideoxy-1,4-imino-L-xylitol?
The CAS number of 1,4-dideoxy-1,4-imino-L-xylitol is 100937-53-9.
What is the molecular formula of 1,4-dideoxy-1,4-imino-L-xylitol?
The molecular formula of 1,4-dideoxy-1,4-imino-L-xylitol is C5H11NO3.
What is the molecular weight of 1,4-dideoxy-1,4-imino-L-xylitol?
The molecular weight of 1,4-dideoxy-1,4-imino-L-xylitol is 133.07 g/mol.
Where can I buy 1,4-dideoxy-1,4-imino-L-xylitol?
You can request a quote for 1,4-dideoxy-1,4-imino-L-xylitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-dideoxy-1,4-imino-L-xylitol?
Yes, KEHONG BIO provides custom synthesis services for 1,4-dideoxy-1,4-imino-L-xylitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.