3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid
TL;DR: 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid (CAS 68790-03-4) is a chemical compound with molecular formula C16H30O4S2 and molecular weight 350.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[10-(2-carboxyethylsulfanyl)decylsulfanyl]propanoic acid
Also Known As: 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid, 3-[10-(2-carboxyethylsulfanyl)decylsulfanyl]propanoic acid, Propanoic acid, 3,3'-[1,10-decanediylbis(thio)]bis-, 3,3'-[Decane-1,10-diylbis(sulfanediyl)]dipropanoic acid
| Molecular Formula | C16H30O4S2 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 17 |
| Exact Mass | 350.15854 |
| Heavy Atoms | 22 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 68790-03-4 |
|---|---|
| SMILES | C(CCCCCSCCC(=O)O)CCCCSCCC(=O)O |
| InChIKey | KHLVSPIFFQSEKD-UHFFFAOYSA-N |
Product Overview
3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid (CAS 68790-03-4), with molecular formula C16H30O4S2 and molecular weight 350.16 g/mol. IUPAC: 3-[10-(2-carboxyethylsulfanyl)decylsulfanyl]propanoic acid.
Chemical Property Profile of 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid
Property Insights of 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid
The XLogP value of 4.1 indicates that 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid. Following Lipinski's Rule of Five, 3-((10-((2-Carboxyethyl)thio)decyl)thio)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-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid?
The CAS number of 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid is 68790-03-4.
What is the molecular formula of 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid?
The molecular formula of 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid is C16H30O4S2.
What is the molecular weight of 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid?
The molecular weight of 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid is 350.16 g/mol.
Where can I buy 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid?
You can request a quote for 3-((10-((2-Carboxyethyl)thio)decyl)thio)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-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((10-((2-Carboxyethyl)thio)decyl)thio)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.