Ononitol, (+)-
TL;DR: Ononitol, (+)- (CAS 5444-27-9) is a chemical compound with molecular formula C7H14O6 and molecular weight 194.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S,4S,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol
Also Known As: D-Pinitol, Pinitol, D-ononitol, Ononitol, Inzitol
| Molecular Formula | C7H14O6 |
|---|---|
| Molecular Weight | 194.08 g/mol |
| LogP | -3.2 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.07904 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 5444-27-9 |
|---|---|
| SMILES | COC1[C@@H]([C@H](C([C@@H]([C@@H]1O)O)O)O)O |
| InChIKey | DSCFFEYYQKSRSV-FEPQRWDDSA-N |
Product Overview
Ononitol, (+)- (CAS 5444-27-9), with molecular formula C7H14O6 and molecular weight 194.08 g/mol. IUPAC: (1S,2S,4S,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol.
Chemical Property Profile of Ononitol, (+)-
Property Insights of Ononitol, (+)-
The XLogP value of -3.2 indicates that Ononitol, (+)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ononitol, (+)-. Following Lipinski's Rule of Five, Ononitol, (+)- has 5 hydrogen bond donor(s) and 6 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 Ononitol, (+)-?
The CAS number of Ononitol, (+)- is 5444-27-9.
What is the molecular formula of Ononitol, (+)-?
The molecular formula of Ononitol, (+)- is C7H14O6.
What is the molecular weight of Ononitol, (+)-?
The molecular weight of Ononitol, (+)- is 194.08 g/mol.
Where can I buy Ononitol, (+)-?
You can request a quote for Ononitol, (+)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ononitol, (+)-?
Yes, KEHONG BIO provides custom synthesis services for Ononitol, (+)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.