Calcium malonate
TL;DR: Calcium malonate (CAS 19455-76-6) is a chemical compound with molecular formula C3H2CaO4 and molecular weight 141.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium propanedioate
Also Known As: Calcium malonate, calcium propanedioate, calcium;propanedioate, CAL-MED, Propanedioic acid calcium salt
| Molecular Formula | C3H2CaO4 |
|---|---|
| Molecular Weight | 141.96 g/mol |
| LogP | -3.5045 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.9579 |
| Heavy Atoms | 8 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 19455-76-6 |
|---|---|
| SMILES | C(C(=O)[O-])C(=O)[O-].[Ca+2] |
| InChIKey | MLMODXBPCNLAGP-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Calcium malonate (CAS 19455-76-6), with molecular formula C3H2CaO4 and molecular weight 141.96 g/mol. IUPAC: calcium propanedioate.
Chemical Property Profile of Calcium malonate
Property Insights of Calcium malonate
The XLogP value of -3.5045 indicates that Calcium malonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium malonate. Following Lipinski's Rule of Five, Calcium malonate has 0 hydrogen bond donor(s) and 4 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 malonate?
The CAS number of Calcium malonate is 19455-76-6.
What is the molecular formula of Calcium malonate?
The molecular formula of Calcium malonate is C3H2CaO4.
What is the molecular weight of Calcium malonate?
The molecular weight of Calcium malonate is 141.96 g/mol.
Where can I buy Calcium malonate?
You can request a quote for Calcium malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium malonate?
Yes, KEHONG BIO provides custom synthesis services for Calcium malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.