![2-[(2,3,5,6-四甲基苯基)硫基]丁酸 structure](/static/products/7246/72462-85-2.webp)
2-[(2,3,5,6-四甲基苯基)硫基]丁酸
TL;DR: 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 (CAS 72462-85-2) is a chemical compound with molecular formula C14H20O2S and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,3,5,6-四甲基苯基)硫基]丁酸
2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid
Also Known As: 2-((2,3,5,6-Tetramethylphenyl)thio)butyric acid, BUTYRIC ACID, 2-((2,3,5,6-TETRAMETHYLPHENYL)THIO)-, 2-[(2,3,5,6-Tetramethylphenyl)sulfanyl]butanoic acid, 2-[(2,3,5,6-Tetramethylphenyl)thio]butyric acid, 2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid
| Molecular Formula | C14H20O2S |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11841 |
| Heavy Atoms | 17 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 72462-85-2 |
|---|---|
| SMILES | CCC(C(=O)O)SC1=C(C(=CC(=C1C)C)C)C |
| InChIKey | JHSOOUIQAKJGQP-UHFFFAOYSA-N |
Product Overview
2-[(2,3,5,6-四甲基苯基)硫基]丁酸 (CAS 72462-85-2), with molecular formula C14H20O2S and molecular weight 252.12 g/mol. IUPAC: 2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid.
Chemical Property Profile of 2-[(2,3,5,6-四甲基苯基)硫基]丁酸
Property Insights of 2-[(2,3,5,6-四甲基苯基)硫基]丁酸
The XLogP value of 4.4 indicates that 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 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-[(2,3,5,6-四甲基苯基)硫基]丁酸. Following Lipinski's Rule of Five, 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 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-[(2,3,5,6-四甲基苯基)硫基]丁酸?
The CAS number of 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 is 72462-85-2.
What is the molecular formula of 2-[(2,3,5,6-四甲基苯基)硫基]丁酸?
The molecular formula of 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 is C14H20O2S.
What is the molecular weight of 2-[(2,3,5,6-四甲基苯基)硫基]丁酸?
The molecular weight of 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 is 252.12 g/mol.
Where can I buy 2-[(2,3,5,6-四甲基苯基)硫基]丁酸?
You can request a quote for 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,3,5,6-四甲基苯基)硫基]丁酸?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,3,5,6-四甲基苯基)硫基]丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.