Citrate
TL;DR: Citrate (CAS 126-44-3) is a chemical compound with molecular formula C6H5O7-3 and molecular weight 189.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypropane-1,2,3-tricarboxylate
Also Known As: citrate, citr, Citrate Ion, citrate salt, citric acid
| Molecular Formula | C6H5O7-3 |
|---|---|
| Molecular Weight | 189.00 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.00352 |
| Heavy Atoms | 13 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 126-44-3 |
|---|---|
| SMILES | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O |
| InChIKey | KRKNYBCHXYNGOX-UHFFFAOYSA-K |
Product Overview
Citrate (CAS 126-44-3), with molecular formula C6H5O7-3 and molecular weight 189.00 g/mol. IUPAC: 2-hydroxypropane-1,2,3-tricarboxylate.
Chemical Property Profile of Citrate
Property Insights of Citrate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Citrate. The TPSA of 141.0 Ų indicates high polarity, suggesting Citrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Citrate 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 Citrate?
The CAS number of Citrate is 126-44-3.
What is the molecular formula of Citrate?
The molecular formula of Citrate is C6H5O7-3.
What is the molecular weight of Citrate?
The molecular weight of Citrate is 189.00 g/mol.
Where can I buy Citrate?
You can request a quote for Citrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Citrate?
Yes, KEHONG BIO provides custom synthesis services for Citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.