Calcium acetate monohydrate
TL;DR: Calcium acetate monohydrate (CAS 5743-26-0) is a chemical compound with molecular formula C4H8CaO5 and molecular weight 176.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium;diacetate;hydrate
Also Known As: Calcium acetate monohydrate, Calcium acetate hydrate, Calcium acetate xhydrate, Calcium acetate, Calcium diacetate monohydrate
| Molecular Formula | C4H8CaO5 |
|---|---|
| Molecular Weight | 176.00 g/mol |
| LogP | -3.69 |
| Topological Polar Surface Area | 81.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.99977 |
| Heavy Atoms | 10 |
| Complexity | 25.0 |
Chemical Identifiers
| CAS Number | 5743-26-0 |
|---|---|
| SMILES | CC(=O)[O-].CC(=O)[O-].O.[Ca+2] |
| InChIKey | XQKKWWCELHKGKB-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Calcium acetate monohydrate (CAS 5743-26-0), with molecular formula C4H8CaO5 and molecular weight 176.00 g/mol. IUPAC: calcium;diacetate;hydrate.
Chemical Property Profile of Calcium acetate monohydrate
Property Insights of Calcium acetate monohydrate
The XLogP value of -3.69 indicates that Calcium acetate monohydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium acetate monohydrate. Following Lipinski's Rule of Five, Calcium acetate monohydrate has 1 hydrogen bond donor(s) and 5 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 Calcium acetate monohydrate?
The CAS number of Calcium acetate monohydrate is 5743-26-0.
What is the molecular formula of Calcium acetate monohydrate?
The molecular formula of Calcium acetate monohydrate is C4H8CaO5.
What is the molecular weight of Calcium acetate monohydrate?
The molecular weight of Calcium acetate monohydrate is 176.00 g/mol.
Where can I buy Calcium acetate monohydrate?
You can request a quote for Calcium acetate monohydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium acetate monohydrate?
Yes, KEHONG BIO provides custom synthesis services for Calcium acetate monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.