Calcium phosphorylcholine
TL;DR: Calcium phosphorylcholine (CAS 4826-71-5) is a chemical compound with molecular formula C5H13CaClNO4P and molecular weight 256.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium;2-(trimethylazaniumyl)ethyl phosphate;chloride
Also Known As: CALCIUM PHOSPHORYLCHOLINE CHLORIDE, Trans-colin, COLIFOS, COLINCALCIUM, EPAFOSFORIL
| Molecular Formula | C5H13CaClNO4P |
|---|---|
| Molecular Weight | 256.99 g/mol |
| LogP | -4.84 |
| Topological Polar Surface Area | 72.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.98965 |
| Heavy Atoms | 13 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 4826-71-5 |
|---|---|
| SMILES | C[N+](C)(C)CCOP(=O)([O-])[O-].[Cl-].[Ca+2] |
| InChIKey | ICVPTJCCKTXCDT-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Calcium phosphorylcholine (CAS 4826-71-5), with molecular formula C5H13CaClNO4P and molecular weight 256.99 g/mol. IUPAC: calcium;2-(trimethylazaniumyl)ethyl phosphate;chloride.
Chemical Property Profile of Calcium phosphorylcholine
Property Insights of Calcium phosphorylcholine
The XLogP value of -4.84 indicates that Calcium phosphorylcholine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium phosphorylcholine. Following Lipinski's Rule of Five, Calcium phosphorylcholine has 0 hydrogen bond donor(s) and 5 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 Calcium phosphorylcholine?
The CAS number of Calcium phosphorylcholine is 4826-71-5.
What is the molecular formula of Calcium phosphorylcholine?
The molecular formula of Calcium phosphorylcholine is C5H13CaClNO4P.
What is the molecular weight of Calcium phosphorylcholine?
The molecular weight of Calcium phosphorylcholine is 256.99 g/mol.
Where can I buy Calcium phosphorylcholine?
You can request a quote for Calcium phosphorylcholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium phosphorylcholine?
Yes, KEHONG BIO provides custom synthesis services for Calcium phosphorylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.