1,4-Dideoxy-1,4-iminomannitol
TL;DR: 1,4-Dideoxy-1,4-iminomannitol (CAS 95189-02-9) is a chemical compound with molecular formula C6H13NO4 and molecular weight 163.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4R)-2-[(1R)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol
Also Known As: 1,4-Dideoxy-1,4-iminomannitol, 1,4-Dideoxy-1,4-imino-D-mannitol, D-Mannitol, 1,4-dideoxy-1,4-imino-, (2R,3S,4R)-2-[(1R)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol, 2alpha-[(R)-1,2-Dihydroxyethyl]pyrrolidine-3alpha,4alpha-diol
| Molecular Formula | C6H13NO4 |
|---|---|
| Molecular Weight | 163.08 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.08446 |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 95189-02-9 |
|---|---|
| SMILES | C1[C@H]([C@H]([C@H](N1)[C@H](CO)O)O)O |
| InChIKey | RVNSAAIWCWTCTJ-JGWLITMVSA-N |
Product Overview
1,4-Dideoxy-1,4-iminomannitol (CAS 95189-02-9), with molecular formula C6H13NO4 and molecular weight 163.08 g/mol. IUPAC: (2R,3S,4R)-2-[(1R)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol.
Chemical Property Profile of 1,4-Dideoxy-1,4-iminomannitol
Property Insights of 1,4-Dideoxy-1,4-iminomannitol
The XLogP value of -2.3 indicates that 1,4-Dideoxy-1,4-iminomannitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dideoxy-1,4-iminomannitol. Following Lipinski's Rule of Five, 1,4-Dideoxy-1,4-iminomannitol has 5 hydrogen bond donor(s) and 5 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-iminomannitol?
The CAS number of 1,4-Dideoxy-1,4-iminomannitol is 95189-02-9.
What is the molecular formula of 1,4-Dideoxy-1,4-iminomannitol?
The molecular formula of 1,4-Dideoxy-1,4-iminomannitol is C6H13NO4.
What is the molecular weight of 1,4-Dideoxy-1,4-iminomannitol?
The molecular weight of 1,4-Dideoxy-1,4-iminomannitol is 163.08 g/mol.
Where can I buy 1,4-Dideoxy-1,4-iminomannitol?
You can request a quote for 1,4-Dideoxy-1,4-iminomannitol 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-iminomannitol?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dideoxy-1,4-iminomannitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.