Tempocholine
TL;DR: Tempocholine (CAS 5453-26-9) is a chemical compound with molecular formula C13H28N2O2+ and molecular weight 244.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: Tempocholine, TEMPO choline, 2-hydroxyethyl-(1-, KST-1B5336, KST-1B5337
| Molecular Formula | C13H28N2O2+ |
|---|---|
| Molecular Weight | 244.22 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 24.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.21507 |
| Heavy Atoms | 17 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 5453-26-9 |
|---|---|
| SMILES | CC1(CC(CC(N1[O])(C)C)[N+](C)(C)CCO)C |
| InChIKey | OEEBLQXRNFLSEO-UHFFFAOYSA-N |
Product Overview
Tempocholine (CAS 5453-26-9), with molecular formula C13H28N2O2+ and molecular weight 244.22 g/mol.
Chemical Property Profile of Tempocholine
Property Insights of Tempocholine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tempocholine. With a topological polar surface area (TPSA) of 24.5 Ų, Tempocholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tempocholine has 1 hydrogen bond donor(s) and 2 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 Tempocholine?
The CAS number of Tempocholine is 5453-26-9.
What is the molecular formula of Tempocholine?
The molecular formula of Tempocholine is C13H28N2O2+.
What is the molecular weight of Tempocholine?
The molecular weight of Tempocholine is 244.22 g/mol.
Where can I buy Tempocholine?
You can request a quote for Tempocholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tempocholine?
Yes, KEHONG BIO provides custom synthesis services for Tempocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.