![[(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid structure](/static/products/2965/29657-33-8.webp)
[(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid
TL;DR: [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid (CAS 29657-33-8) is a chemical compound with molecular formula C14H28O2S and molecular weight 260.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3,4,4,5,5-hexamethylhexan-2-ylsulfanyl)acetic acid
Also Known As: (tert-Dodecylthio)acetic acid, [(2,3,4,4,5,5-hexamethylhexan-2-yl)sulfanyl]acetic acid, 2-(2,3,4,4,5,5-hexamethylhexan-2-ylsulfanyl)acetic acid, EINECS 249-756-5
| Molecular Formula | C14H28O2S |
|---|---|
| Molecular Weight | 260.18 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 260.181 |
| Heavy Atoms | 17 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 29657-33-8 |
|---|---|
| SMILES | CC(C(C)(C)C(C)(C)C)C(C)(C)SCC(=O)O |
| InChIKey | LNRGMECDIPGOEV-UHFFFAOYSA-N |
Product Overview
[(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid (CAS 29657-33-8), with molecular formula C14H28O2S and molecular weight 260.18 g/mol. IUPAC: 2-(2,3,4,4,5,5-hexamethylhexan-2-ylsulfanyl)acetic acid.
Chemical Property Profile of [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid
Property Insights of [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid
The XLogP value of 4.8 indicates that [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid. Following Lipinski's Rule of Five, [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic 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 [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid?
The CAS number of [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid is 29657-33-8.
What is the molecular formula of [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid?
The molecular formula of [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid is C14H28O2S.
What is the molecular weight of [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid?
The molecular weight of [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid is 260.18 g/mol.
Where can I buy [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid?
You can request a quote for [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(2,3,4,4,5,5-Hexamethylhexan-2-yl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.