Thiocure petma
TL;DR: Thiocure petma (CAS 10193-99-4) is a chemical compound with molecular formula C13H20O8S4 and molecular weight 432.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-sulfanylacetyl)oxy-2,2-bis[(2-sulfanylacetyl)oxymethyl]propyl] 2-sulfanylacetate
Also Known As: Thiocure petma, Pentaerythritol tetrakis(2-mercaptoacetate), Pentaerythritol tetrathioglycolate, PETG, Pentaerythritol tetrakis(mercaptoacetate)
| Molecular Formula | C13H20O8S4 |
|---|---|
| Molecular Weight | 432.00 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 16 |
| Exact Mass | 432.0041 |
| Heavy Atoms | 25 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 10193-99-4 |
|---|---|
| SMILES | C(C(=O)OCC(COC(=O)CS)(COC(=O)CS)COC(=O)CS)S |
| InChIKey | RUDUCNPHDIMQCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiocure petma (CAS 10193-99-4), with molecular formula C13H20O8S4 and molecular weight 432.00 g/mol. IUPAC: [3-(2-sulfanylacetyl)oxy-2,2-bis[(2-sulfanylacetyl)oxymethyl]propyl] 2-sulfanylacetate.
Chemical Property Profile of Thiocure petma
Property Insights of Thiocure petma
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiocure petma. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiocure petma. Following Lipinski's Rule of Five, Thiocure petma has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thiocure petma?
The CAS number of Thiocure petma is 10193-99-4.
What is the molecular formula of Thiocure petma?
The molecular formula of Thiocure petma is C13H20O8S4.
What is the molecular weight of Thiocure petma?
The molecular weight of Thiocure petma is 432.00 g/mol.
Where can I buy Thiocure petma?
You can request a quote for Thiocure petma directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiocure petma?
Yes, KEHONG BIO provides custom synthesis services for Thiocure petma and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.