亚甲基柠檬酸
TL;DR: 亚甲基柠檬酸 (CAS 126-20-5) is a chemical compound with molecular formula C7H6Na2O7 and molecular weight 247.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
亚甲基柠檬酸
disodium;2-[4-(carboxylatomethyl)-5-oxo-1,3-dioxolan-4-yl]acetate
Also Known As: Methylenecitric acid, Goutin, methylene citric acid sodium salt, Disodium 5-oxo-1,3-dioxolan-4-ylidenedi(acetate), 4-oxo-1,3-dioxolane-5,5'-diacetic acid
| Molecular Formula | C7H6Na2O7 |
|---|---|
| Molecular Weight | 247.99 g/mol |
| LogP | -9.46 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.99089 |
| Heavy Atoms | 16 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 126-20-5 |
|---|---|
| SMILES | C1OC(=O)C(O1)(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+] |
| InChIKey | HGXYMHQZIAWNKI-UHFFFAOYSA-L |
Product Overview
亚甲基柠檬酸 (CAS 126-20-5), with molecular formula C7H6Na2O7 and molecular weight 247.99 g/mol. IUPAC: disodium;2-[4-(carboxylatomethyl)-5-oxo-1,3-dioxolan-4-yl]acetate.
Chemical Property Profile of 亚甲基柠檬酸
Property Insights of 亚甲基柠檬酸
The XLogP value of -9.46 indicates that 亚甲基柠檬酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 亚甲基柠檬酸. Following Lipinski's Rule of Five, 亚甲基柠檬酸 has 0 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 亚甲基柠檬酸?
The CAS number of 亚甲基柠檬酸 is 126-20-5.
What is the molecular formula of 亚甲基柠檬酸?
The molecular formula of 亚甲基柠檬酸 is C7H6Na2O7.
What is the molecular weight of 亚甲基柠檬酸?
The molecular weight of 亚甲基柠檬酸 is 247.99 g/mol.
Where can I buy 亚甲基柠檬酸?
You can request a quote for 亚甲基柠檬酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 亚甲基柠檬酸?
Yes, KEHONG BIO provides custom synthesis services for 亚甲基柠檬酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.