Cyclocholine
TL;DR: Cyclocholine (CAS 57637-90-8) is a chemical compound with molecular formula C[N+]1(CC1)CCO and molecular weight 102.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methylaziridin-1-ium-1-yl)ethanol
Also Known As: Cyclocholine, Choline mustard aziridinium, Aziridinium, 1-(2-hydroxyethyl)-1-methyl-, 2-(1-methylaziridin-1-ium-1-yl)ethanol, 1-Methyl-1-(2-hydroxyethyl)aziridinium
| Molecular Formula | C[N+]1(CC1)CCO |
|---|---|
| Molecular Weight | 102.09 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.09189 |
| Heavy Atoms | 7 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 57637-90-8 |
|---|---|
| SMILES | C[N+]1(CC1)CCO |
| InChIKey | RHRQMEQRKMIIQM-UHFFFAOYSA-N |
Product Overview
Cyclocholine (CAS 57637-90-8), with molecular formula C[N+]1(CC1)CCO and molecular weight 102.09 g/mol. IUPAC: 2-(1-methylaziridin-1-ium-1-yl)ethanol.
Chemical Property Profile of Cyclocholine
Property Insights of Cyclocholine
The XLogP value of -0.6 indicates that Cyclocholine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.2 Ų, Cyclocholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclocholine has 1 hydrogen bond donor(s) and 1 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 Cyclocholine?
The CAS number of Cyclocholine is 57637-90-8.
What is the molecular formula of Cyclocholine?
The molecular formula of Cyclocholine is C[N+]1(CC1)CCO.
What is the molecular weight of Cyclocholine?
The molecular weight of Cyclocholine is 102.09 g/mol.
Where can I buy Cyclocholine?
You can request a quote for Cyclocholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclocholine?
Yes, KEHONG BIO provides custom synthesis services for Cyclocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.