Methyl alpha-cyclohexylthiophen-2-acetate
TL;DR: Methyl alpha-cyclohexylthiophen-2-acetate (CAS 55504-38-6) is a chemical compound with molecular formula C13H18O2S and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-cyclohexyl-2-thiophen-2-ylacetate
Also Known As: Methyl alpha-cyclohexylthiophen-2-acetate, EINECS 259-678-3, methyl 2-cyclohexyl-2-thiophen-2-ylacetate, Methyl cyclohexyl(thiophen-2-yl)acetate
| Molecular Formula | C13H18O2S |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 3.585 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.10275 |
| Heavy Atoms | 16 |
| Complexity | 325.7116 |
Chemical Identifiers
| CAS Number | 55504-38-6 |
|---|---|
| SMILES | COC(=O)C(C1CCCCC1)C2=CC=CS2 |
Product Overview
Methyl alpha-cyclohexylthiophen-2-acetate (CAS 55504-38-6), with molecular formula C13H18O2S and molecular weight 238.10 g/mol. IUPAC: methyl 2-cyclohexyl-2-thiophen-2-ylacetate.
Chemical Property Profile of Methyl alpha-cyclohexylthiophen-2-acetate
Property Insights of Methyl alpha-cyclohexylthiophen-2-acetate
The XLogP value of 3.585 indicates that Methyl alpha-cyclohexylthiophen-2-acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl alpha-cyclohexylthiophen-2-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl alpha-cyclohexylthiophen-2-acetate has 0 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 Methyl alpha-cyclohexylthiophen-2-acetate?
The CAS number of Methyl alpha-cyclohexylthiophen-2-acetate is 55504-38-6.
What is the molecular formula of Methyl alpha-cyclohexylthiophen-2-acetate?
The molecular formula of Methyl alpha-cyclohexylthiophen-2-acetate is C13H18O2S.
What is the molecular weight of Methyl alpha-cyclohexylthiophen-2-acetate?
The molecular weight of Methyl alpha-cyclohexylthiophen-2-acetate is 238.10 g/mol.
Where can I buy Methyl alpha-cyclohexylthiophen-2-acetate?
You can request a quote for Methyl alpha-cyclohexylthiophen-2-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl alpha-cyclohexylthiophen-2-acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl alpha-cyclohexylthiophen-2-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.