![3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid structure](/static/products/6147/61473-66-3.webp)
3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid
TL;DR: 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid (CAS 61473-66-3) is a chemical compound with molecular formula C10H20O2S and molecular weight 204.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylhexan-2-ylsulfanyl)propanoic acid
Also Known As: 3-[(2-methylhexan-2-yl)sulfanyl]propanoic acid, 3-(2-methylhexan-2-ylsulfanyl)propanoic acid
| Molecular Formula | C10H20O2S |
|---|---|
| Molecular Weight | 204.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 204.11841 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 61473-66-3 |
|---|---|
| SMILES | CCCCC(C)(C)SCCC(=O)O |
| InChIKey | CJABRWTVUKAJSJ-UHFFFAOYSA-N |
Product Overview
3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid (CAS 61473-66-3), with molecular formula C10H20O2S and molecular weight 204.12 g/mol. IUPAC: 3-(2-methylhexan-2-ylsulfanyl)propanoic acid.
Chemical Property Profile of 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid
Property Insights of 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid. Following Lipinski's Rule of Five, 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid has 1 hydrogen bond donor(s) and 3 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-Methylhexan-2-yl)sulfanyl]propanoic acid?
The CAS number of 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid is 61473-66-3.
What is the molecular formula of 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid?
The molecular formula of 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid is C10H20O2S.
What is the molecular weight of 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid?
The molecular weight of 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid is 204.12 g/mol.
Where can I buy 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid?
You can request a quote for 3-[(2-Methylhexan-2-yl)sulfanyl]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-Methylhexan-2-yl)sulfanyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-Methylhexan-2-yl)sulfanyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.