1-deoxy-1-nitro-D-mannitol
TL;DR: 1-deoxy-1-nitro-D-mannitol (CAS 14199-83-8) is a chemical compound with molecular formula C6H13NO7 and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4R,5R)-6-nitrohexane-1,2,3,4,5-pentol
Also Known As: 1-Deoxy-1-nitro-D-mannitol, 1-Nitro-1-deoxy-D-mannitol, 6-nitrohexane-1,2,3,4,5-pentol, (2R,3R,4R,5R)-6-nitrohexane-1,2,3,4,5-pentol, EINECS 238-051-8
| Molecular Formula | C6H13NO7 |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | -3.301 |
| Topological Polar Surface Area | 144.29 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 211.0692 |
| Heavy Atoms | 14 |
| Complexity | 187.01883 |
Chemical Identifiers
| CAS Number | 14199-83-8 |
|---|---|
| SMILES | C([C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)[N+](=O)[O-] |
Product Overview
1-deoxy-1-nitro-D-mannitol (CAS 14199-83-8), with molecular formula C6H13NO7 and molecular weight 211.07 g/mol. IUPAC: (2R,3R,4R,5R)-6-nitrohexane-1,2,3,4,5-pentol.
Chemical Property Profile of 1-deoxy-1-nitro-D-mannitol
Property Insights of 1-deoxy-1-nitro-D-mannitol
The XLogP value of -3.301 indicates that 1-deoxy-1-nitro-D-mannitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.29 Ų indicates high polarity, suggesting 1-deoxy-1-nitro-D-mannitol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-deoxy-1-nitro-D-mannitol has 5 hydrogen bond donor(s) and 7 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-deoxy-1-nitro-D-mannitol?
The CAS number of 1-deoxy-1-nitro-D-mannitol is 14199-83-8.
What is the molecular formula of 1-deoxy-1-nitro-D-mannitol?
The molecular formula of 1-deoxy-1-nitro-D-mannitol is C6H13NO7.
What is the molecular weight of 1-deoxy-1-nitro-D-mannitol?
The molecular weight of 1-deoxy-1-nitro-D-mannitol is 211.07 g/mol.
Where can I buy 1-deoxy-1-nitro-D-mannitol?
You can request a quote for 1-deoxy-1-nitro-D-mannitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-deoxy-1-nitro-D-mannitol?
Yes, KEHONG BIO provides custom synthesis services for 1-deoxy-1-nitro-D-mannitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.