Brushite
TL;DR: Brushite (CAS 7789-77-7) is a chemical compound with molecular formula CaH5O6P and molecular weight 171.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium;hydrogen phosphate;dihydrate
Also Known As: calcium hydrogenphosphate dihydrate, brushite, Aksepillen, Calcium hydrogen phosphate dihydrate, Eunova
| Molecular Formula | CaH5O6P |
|---|---|
| Molecular Weight | 171.94 g/mol |
| LogP | -4.22 |
| Topological Polar Surface Area | 85.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 171.94496 |
| Heavy Atoms | 8 |
| Complexity | 46.0 |
| Density | 2.89 @25 °C |
Chemical Identifiers
| CAS Number | 7789-77-7 |
|---|---|
| SMILES | O.O.OP(=O)([O-])[O-].[Ca+2] |
| InChIKey | XAAHAAMILDNBPS-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Brushite (CAS 7789-77-7), with molecular formula CaH5O6P and molecular weight 171.94 g/mol. IUPAC: calcium;hydrogen phosphate;dihydrate.
Chemical Property Profile of Brushite
Property Insights of Brushite
The XLogP value of -4.22 indicates that Brushite is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 85.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Brushite. Following Lipinski's Rule of Five, Brushite has 3 hydrogen bond donor(s) and 6 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 Brushite?
The CAS number of Brushite is 7789-77-7.
What is the molecular formula of Brushite?
The molecular formula of Brushite is CaH5O6P.
What is the molecular weight of Brushite?
The molecular weight of Brushite is 171.94 g/mol.
Where can I buy Brushite?
You can request a quote for Brushite directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brushite?
Yes, KEHONG BIO provides custom synthesis services for Brushite and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.