Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester
TL;DR: Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester (CAS 60642-69-5) is a chemical compound with molecular formula C14H26O4S2 and molecular weight 322.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-sulfanylethyl) decanedioate
Also Known As: Bis sebacate, Bis(2-mercaptoethyl) sebacate, bis(2-sulfanylethyl) sebacate, bis(2-sulfanylethyl) decanedioate, bis-(2-Mercaptoethyl) sebacate
| Molecular Formula | C14H26O4S2 |
|---|---|
| Molecular Weight | 322.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 322.12726 |
| Heavy Atoms | 20 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 60642-69-5 |
|---|---|
| SMILES | C(CCCCC(=O)OCCS)CCCC(=O)OCCS |
| InChIKey | ZQYBCMFYQIVHKA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester (CAS 60642-69-5), with molecular formula C14H26O4S2 and molecular weight 322.13 g/mol. IUPAC: bis(2-sulfanylethyl) decanedioate.
Chemical Property Profile of Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester
Property Insights of Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester
The XLogP value of 3.3 indicates that Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester has 2 hydrogen bond donor(s) and 6 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 Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester?
The CAS number of Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester is 60642-69-5.
What is the molecular formula of Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester?
The molecular formula of Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester is C14H26O4S2.
What is the molecular weight of Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester?
The molecular weight of Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester is 322.13 g/mol.
Where can I buy Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester?
You can request a quote for Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Decanedioic acid, 1,10-bis(2-mercaptoethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.