Calcium isostearate
TL;DR: Calcium isostearate (CAS 59963-30-3) is a chemical compound with molecular formula C36H70CaO4 and molecular weight 606.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(16-methylheptadecanoate)
Also Known As: calcium isostearate, Calcium isooctadecanoate, calciumisooctadecanoate, calcium 16-methylheptadecanoate, EINECS 261-999-9
| Molecular Formula | C36H70CaO4 |
|---|---|
| Molecular Weight | 606.49 g/mol |
| LogP | 9.3266 |
| Topological Polar Surface Area | 80.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 30 |
| Exact Mass | 606.49 |
| Heavy Atoms | 41 |
| Complexity | 475.71002 |
Chemical Identifiers
| CAS Number | 59963-30-3 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCCCCCC(=O)[O-].CC(C)CCCCCCCCCCCCCCC(=O)[O-].[Ca+2] |
Product Overview
Calcium isostearate (CAS 59963-30-3), with molecular formula C36H70CaO4 and molecular weight 606.49 g/mol. IUPAC: calcium bis(16-methylheptadecanoate).
Chemical Property Profile of Calcium isostearate
Property Insights of Calcium isostearate
The XLogP value of 9.3266 indicates that Calcium isostearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.26 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium isostearate. Following Lipinski's Rule of Five, Calcium isostearate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Calcium isostearate?
The CAS number of Calcium isostearate is 59963-30-3.
What is the molecular formula of Calcium isostearate?
The molecular formula of Calcium isostearate is C36H70CaO4.
What is the molecular weight of Calcium isostearate?
The molecular weight of Calcium isostearate is 606.49 g/mol.
Where can I buy Calcium isostearate?
You can request a quote for Calcium isostearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium isostearate?
Yes, KEHONG BIO provides custom synthesis services for Calcium isostearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.