檸檬酸鈉
TL;DR: 檸檬酸鈉 (CAS 68-04-2) is a chemical compound with molecular formula C6H5Na3O7 and molecular weight 257.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
檸檬酸鈉
trisodium;2-hydroxypropane-1,2,3-tricarboxylate
Also Known As: Sodium citrate, TRISODIUM CITRATE, Citrosodine, Natrocitral, Citrosodina
| Molecular Formula | C6H5Na3O7 |
|---|---|
| Molecular Weight | 257.97 g/mol |
| LogP | -14.24 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.97284 |
| Heavy Atoms | 16 |
| Complexity | 211.0 |
| Melting Point | 300 |
| Boiling Point | BP: Decomposes at red heat /Dihydrate/ |
| Solubility | 29.4g/L |
Chemical Identifiers
| CAS Number | 68-04-2 |
|---|---|
| SMILES | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Na+].[Na+].[Na+] |
| InChIKey | HRXKRNGNAMMEHJ-UHFFFAOYSA-K |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
檸檬酸鈉 (CAS 68-04-2), with molecular formula C6H5Na3O7 and molecular weight 257.97 g/mol. IUPAC: trisodium;2-hydroxypropane-1,2,3-tricarboxylate.
Chemical Property Profile of 檸檬酸鈉
Property Insights of 檸檬酸鈉
The XLogP value of -14.24 indicates that 檸檬酸鈉 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting 檸檬酸鈉 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 檸檬酸鈉 has 1 hydrogen bond donor(s) and 7 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 檸檬酸鈉?
The CAS number of 檸檬酸鈉 is 68-04-2.
What is the molecular formula of 檸檬酸鈉?
The molecular formula of 檸檬酸鈉 is C6H5Na3O7.
What is the molecular weight of 檸檬酸鈉?
The molecular weight of 檸檬酸鈉 is 257.97 g/mol.
Where can I buy 檸檬酸鈉?
You can request a quote for 檸檬酸鈉 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 檸檬酸鈉?
Yes, KEHONG BIO provides custom synthesis services for 檸檬酸鈉 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.