Calcium 2-sulfanylacetate
TL;DR: Calcium 2-sulfanylacetate (CAS 86030-83-3) is a chemical compound with molecular formula C2H3CaO2S+ and molecular weight 130.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium 2-sulfanylacetate
Also Known As: Calcium sulphidoacetate, calcium 2-sulfanylacetate, Acetic acid, mercapto-, calcium salt
| Molecular Formula | C2H3CaO2S+ |
|---|---|
| Molecular Weight | 130.95 g/mol |
| LogP | -1.7147 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.94797 |
| Heavy Atoms | 6 |
| Complexity | 37.0 |
Chemical Identifiers
| CAS Number | 86030-83-3 |
|---|---|
| SMILES | C(C(=O)[O-])S.[Ca+2] |
| InChIKey | QVCFQEFEMBCIOI-UHFFFAOYSA-M |
Product Overview
Calcium 2-sulfanylacetate (CAS 86030-83-3), with molecular formula C2H3CaO2S+ and molecular weight 130.95 g/mol. IUPAC: calcium 2-sulfanylacetate.
Chemical Property Profile of Calcium 2-sulfanylacetate
Property Insights of Calcium 2-sulfanylacetate
The XLogP value of -1.7147 indicates that Calcium 2-sulfanylacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.1 Ų, Calcium 2-sulfanylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Calcium 2-sulfanylacetate has 1 hydrogen bond donor(s) and 3 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 2-sulfanylacetate?
The CAS number of Calcium 2-sulfanylacetate is 86030-83-3.
What is the molecular formula of Calcium 2-sulfanylacetate?
The molecular formula of Calcium 2-sulfanylacetate is C2H3CaO2S+.
What is the molecular weight of Calcium 2-sulfanylacetate?
The molecular weight of Calcium 2-sulfanylacetate is 130.95 g/mol.
Where can I buy Calcium 2-sulfanylacetate?
You can request a quote for Calcium 2-sulfanylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium 2-sulfanylacetate?
Yes, KEHONG BIO provides custom synthesis services for Calcium 2-sulfanylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.