![2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol structure](/static/products/5291/5291-31-6.webp)
2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol
TL;DR: 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol (CAS 5291-31-6) is a chemical compound with molecular formula C9H17NO3 and molecular weight 187.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol
Also Known As: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol, 7,7-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-8-ol
| Molecular Formula | C9H17NO3 |
|---|---|
| Molecular Weight | 187.12 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 63.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.12085 |
| Heavy Atoms | 13 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 5291-31-6 |
|---|---|
| SMILES | C1CN2CCC1C(C2(CO)CO)O |
| InChIKey | DUCZTSWDCHMOFG-UHFFFAOYSA-N |
Product Overview
2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol (CAS 5291-31-6), with molecular formula C9H17NO3 and molecular weight 187.12 g/mol. IUPAC: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol.
Chemical Property Profile of 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol
Property Insights of 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol
The XLogP value of -0.8 indicates that 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol 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 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol. Following Lipinski's Rule of Five, 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol 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 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol?
The CAS number of 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol is 5291-31-6.
What is the molecular formula of 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol?
The molecular formula of 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol is C9H17NO3.
What is the molecular weight of 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol?
The molecular weight of 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol is 187.12 g/mol.
Where can I buy 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol?
You can request a quote for 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.