![3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid structure](/static/products/4025/40252-80-0.webp)
3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid
TL;DR: 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid (CAS 40252-80-0) is a chemical compound with molecular formula C8H14O4S2 and molecular weight 238.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(2-carboxyethylsulfanyl)ethylsulfanyl]propanoic acid
Also Known As: 4,7-dithia-decanedioic acid, 3,3'-(Ethylenedithio)dipropionic acid, 3,3 -(Ethylenedithio)dipropionic acid, 3-[2-(2-carboxyethylsulfanyl)ethylsulfanyl]propanoic acid, Propanoic acid,3,3'-[1,2-ethanediylbis(thio)]bis-
| Molecular Formula | C8H14O4S2 |
|---|---|
| Molecular Weight | 238.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 238.03336 |
| Heavy Atoms | 14 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 40252-80-0 |
|---|---|
| SMILES | C(CSCCSCCC(=O)O)C(=O)O |
| InChIKey | GNMCEWMUFTZBKH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid (CAS 40252-80-0), with molecular formula C8H14O4S2 and molecular weight 238.03 g/mol. IUPAC: 3-[2-(2-carboxyethylsulfanyl)ethylsulfanyl]propanoic acid.
Chemical Property Profile of 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid
Property Insights of 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid. Following Lipinski's Rule of Five, 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid 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 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid?
The CAS number of 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid is 40252-80-0.
What is the molecular formula of 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid?
The molecular formula of 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid is C8H14O4S2.
What is the molecular weight of 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid?
The molecular weight of 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid is 238.03 g/mol.
Where can I buy 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid?
You can request a quote for 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(2-Carboxyethylsulfanyl)ethylsulfanyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.