六亚甲基四胺柠檬酸盐
TL;DR: 六亚甲基四胺柠檬酸盐 (CAS 34317-08-3) is a chemical compound with molecular formula C12H20N4O7 and molecular weight 332.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
六亚甲基四胺柠檬酸盐
2-hydroxypropane-1,2,3-tricarboxylic acid;1,3,5,7-tetrazatricyclo[3.3.1.13,7]decane
Also Known As: Methenamine citrate, Hexamethylenetetramine citrate, CITROFORMENE, HEXAMETHYLENETETRAMINE, CITRATE (1:1), 1,3,5,7-tetraazatricyclo[3.3.1.13,7]decane 2-hydroxypropane-1,2,3-tricarboxylate(1:1)
| Molecular Formula | C12H20N4O7 |
|---|---|
| Molecular Weight | 332.13 g/mol |
| LogP | -2.27 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.1332 |
| Heavy Atoms | 23 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 34317-08-3 |
|---|---|
| SMILES | C1N2CN3CN1CN(C2)C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | UAMIYHCXAONPMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
六亚甲基四胺柠檬酸盐 (CAS 34317-08-3), with molecular formula C12H20N4O7 and molecular weight 332.13 g/mol. IUPAC: 2-hydroxypropane-1,2,3-tricarboxylic acid;1,3,5,7-tetrazatricyclo[3.3.1.13,7]decane.
Chemical Property Profile of 六亚甲基四胺柠檬酸盐
Property Insights of 六亚甲基四胺柠檬酸盐
The XLogP value of -2.27 indicates that 六亚甲基四胺柠檬酸盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.0 Ų indicates high polarity, suggesting 六亚甲基四胺柠檬酸盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 六亚甲基四胺柠檬酸盐 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 六亚甲基四胺柠檬酸盐?
The CAS number of 六亚甲基四胺柠檬酸盐 is 34317-08-3.
What is the molecular formula of 六亚甲基四胺柠檬酸盐?
The molecular formula of 六亚甲基四胺柠檬酸盐 is C12H20N4O7.
What is the molecular weight of 六亚甲基四胺柠檬酸盐?
The molecular weight of 六亚甲基四胺柠檬酸盐 is 332.13 g/mol.
Where can I buy 六亚甲基四胺柠檬酸盐?
You can request a quote for 六亚甲基四胺柠檬酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 六亚甲基四胺柠檬酸盐?
Yes, KEHONG BIO provides custom synthesis services for 六亚甲基四胺柠檬酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.