![2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol structure](/static/products/1053/105384-29-0.webp)
2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol
TL;DR: 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol (CAS 105384-29-0) is a chemical compound with molecular formula C8H15NO3 and molecular weight 173.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol
Also Known As: 2-Hydroxymethyl-3,3-dihydroxyquinuclidine, 2-(hydroxymethyl)quinuclidine-3,3-diol, 2-hydroxymethyl-3,3-dihydroxy-quinuclidine, 2-(hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol
| Molecular Formula | C8H15NO3 |
|---|---|
| Molecular Weight | 173.11 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 63.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.1052 |
| Heavy Atoms | 12 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 105384-29-0 |
|---|---|
| SMILES | C1CN2CCC1C(C2CO)(O)O |
| InChIKey | ZFEXCXNDPOKNKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol (CAS 105384-29-0), with molecular formula C8H15NO3 and molecular weight 173.11 g/mol. IUPAC: 2-(hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol.
Chemical Property Profile of 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol
Property Insights of 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol
The XLogP value of -0.7 indicates that 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol. Following Lipinski's Rule of Five, 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol has 3 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 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol?
The CAS number of 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol is 105384-29-0.
What is the molecular formula of 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol?
The molecular formula of 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol is C8H15NO3.
What is the molecular weight of 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol?
The molecular weight of 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol is 173.11 g/mol.
Where can I buy 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol?
You can request a quote for 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Hydroxymethyl)-1-azabicyclo[2.2.2]octane-3,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.