Dicalcium Etidronate
TL;DR: Dicalcium Etidronate (CAS 75323-71-6) is a chemical compound with molecular formula C2H4Ca2O7P2 and molecular weight 281.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dicalcium;1,1-diphosphonatoethanol
Also Known As: Dicalcium Etidronate, ETIDRONATE DICALCIUM, Fluorescein thiosemicarbazide, dicalcium;1,1-diphosphonatoethanol, dicalcium 1,1-diphosphonatoethanol
| Molecular Formula | C2H4Ca2O7P2 |
|---|---|
| Molecular Weight | 281.87 g/mol |
| LogP | -4.2818 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 281.8684 |
| Heavy Atoms | 13 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 75323-71-6 |
|---|---|
| SMILES | CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[Ca+2].[Ca+2] |
| InChIKey | TUBWTBBJUXNAAK-UHFFFAOYSA-J |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dicalcium Etidronate (CAS 75323-71-6), with molecular formula C2H4Ca2O7P2 and molecular weight 281.87 g/mol. IUPAC: dicalcium;1,1-diphosphonatoethanol.
Chemical Property Profile of Dicalcium Etidronate
Property Insights of Dicalcium Etidronate
The XLogP value of -4.2818 indicates that Dicalcium Etidronate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting Dicalcium Etidronate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dicalcium Etidronate 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 Dicalcium Etidronate?
The CAS number of Dicalcium Etidronate is 75323-71-6.
What is the molecular formula of Dicalcium Etidronate?
The molecular formula of Dicalcium Etidronate is C2H4Ca2O7P2.
What is the molecular weight of Dicalcium Etidronate?
The molecular weight of Dicalcium Etidronate is 281.87 g/mol.
Where can I buy Dicalcium Etidronate?
You can request a quote for Dicalcium Etidronate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dicalcium Etidronate?
Yes, KEHONG BIO provides custom synthesis services for Dicalcium Etidronate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.