Zinc di(toluene-4-sulphonate)
TL;DR: Zinc di(toluene-4-sulphonate) (CAS 13438-45-4) is a chemical compound with molecular formula C14H14O6S2Zn and molecular weight 405.95233 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
zinc bis(4-methylbenzenesulfonate)
Also Known As: zinc tosylate, zinc p-toluenesulfonate, zinc(II) p-toluenesulfonate, zincp-toluenesulfonate, Zinc di(toluene-4-sulphonate)
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H14O6S2Zn |
| Molecular Weight | 405.95233 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 405.95233 Da |
| Heavy Atoms | 23 |
| Complexity | 193.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].[Zn+2] |
| InChIKey | YISPIDBWTUCKKH-UHFFFAOYSA-L |
Chemical Property Profile of Zinc di(toluene-4-sulphonate)
Property Insights of Zinc di(toluene-4-sulphonate)
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Zinc di(toluene-4-sulphonate). The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Zinc di(toluene-4-sulphonate). Following Lipinski's Rule of Five, Zinc di(toluene-4-sulphonate) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Zinc di(toluene-4-sulphonate)?
The CAS number of Zinc di(toluene-4-sulphonate) is 13438-45-4.
What is the molecular formula of Zinc di(toluene-4-sulphonate)?
The molecular formula of Zinc di(toluene-4-sulphonate) is C14H14O6S2Zn.
What is the molecular weight of Zinc di(toluene-4-sulphonate)?
The molecular weight of Zinc di(toluene-4-sulphonate) is 405.95233 g/mol.
Where can I buy Zinc di(toluene-4-sulphonate)?
You can request a quote for Zinc di(toluene-4-sulphonate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Zinc di(toluene-4-sulphonate)?
Yes, CoreyChem provides custom synthesis services for Zinc di(toluene-4-sulphonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.