Calcium bis(octadec-9-enyl sulfate)
TL;DR: Calcium bis(octadec-9-enyl sulfate) (CAS 72018-26-9) is a chemical compound with molecular formula C36H70CaO8S2 and molecular weight 734.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(octadec-9-enyl sulfate)
Also Known As: Calcium oleyl sulfate
| Molecular Formula | C36H70CaO8S2 |
|---|---|
| Molecular Weight | 734.41 g/mol |
| LogP | 10.6206 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 32 |
| Exact Mass | 734.4138 |
| Heavy Atoms | 47 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 72018-26-9 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCC=CCCCCCCCCOS(=O)(=O)[O-].[Ca+2] |
| InChIKey | VNOZDWNXEDODNQ-UHFFFAOYSA-L |
Product Overview
Calcium bis(octadec-9-enyl sulfate) (CAS 72018-26-9), with molecular formula C36H70CaO8S2 and molecular weight 734.41 g/mol. IUPAC: calcium bis(octadec-9-enyl sulfate).
Chemical Property Profile of Calcium bis(octadec-9-enyl sulfate)
Property Insights of Calcium bis(octadec-9-enyl sulfate)
The XLogP value of 10.6206 indicates that Calcium bis(octadec-9-enyl sulfate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting Calcium bis(octadec-9-enyl sulfate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Calcium bis(octadec-9-enyl sulfate) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Calcium bis(octadec-9-enyl sulfate)?
The CAS number of Calcium bis(octadec-9-enyl sulfate) is 72018-26-9.
What is the molecular formula of Calcium bis(octadec-9-enyl sulfate)?
The molecular formula of Calcium bis(octadec-9-enyl sulfate) is C36H70CaO8S2.
What is the molecular weight of Calcium bis(octadec-9-enyl sulfate)?
The molecular weight of Calcium bis(octadec-9-enyl sulfate) is 734.41 g/mol.
Where can I buy Calcium bis(octadec-9-enyl sulfate)?
You can request a quote for Calcium bis(octadec-9-enyl sulfate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium bis(octadec-9-enyl sulfate)?
Yes, KEHONG BIO provides custom synthesis services for Calcium bis(octadec-9-enyl sulfate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.