![[4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate structure](/static/products/2565/256525-65-2.webp)
[4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate
TL;DR: [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate (CAS 256525-65-2) is a chemical compound with molecular formula C17H17F3O2S and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methyl 2,2-dimethylpropanoate
Also Known As: [4-phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate|[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methyl 2,2-dimethylpropanoate|C17H17F3O2S
| Molecular Formula | C17H17F3O2S |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 5.5232 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.09015 |
| Heavy Atoms | 23 |
| Complexity | 682.0994 |
Chemical Identifiers
| CAS Number | 256525-65-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)OCC1=CC(=C(S1)C(F)(F)F)C2=CC=CC=C2 |
Product Overview
[4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate (CAS 256525-65-2), with molecular formula C17H17F3O2S and molecular weight 342.09 g/mol. IUPAC: [4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methyl 2,2-dimethylpropanoate.
Chemical Property Profile of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate
Property Insights of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate
The XLogP value of 5.5232 indicates that [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate?
The CAS number of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate is 256525-65-2.
What is the molecular formula of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate?
The molecular formula of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate is C17H17F3O2S.
What is the molecular weight of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate?
The molecular weight of [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate is 342.09 g/mol.
Where can I buy [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate?
You can request a quote for [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate?
Yes, KEHONG BIO provides custom synthesis services for [4-Phenyl-5-(trifluoromethyl)-2-thienyl]methyl pivalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.