Cyclopentyl trifluoroacetate
TL;DR: Cyclopentyl trifluoroacetate (CAS 703-13-9) is a chemical compound with molecular formula C7H9F3O2 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 2,2,2-trifluoroacetate
Also Known As: Cyclopentyl trifluoroacetate, cyclopentyl 2,2,2-trifluoroacetate, Cyclopentyltrifluoroacetate, Cyclopentyl-trifluoracetat, Cyclopentyl trifluoroacetate #
| Molecular Formula | C7H9F3O2 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.05547 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 703-13-9 |
|---|---|
| SMILES | C1CCC(C1)OC(=O)C(F)(F)F |
| InChIKey | QCONYJQZFUESJD-UHFFFAOYSA-N |
Product Overview
Cyclopentyl trifluoroacetate (CAS 703-13-9), with molecular formula C7H9F3O2 and molecular weight 182.06 g/mol. IUPAC: cyclopentyl 2,2,2-trifluoroacetate.
Chemical Property Profile of Cyclopentyl trifluoroacetate
Property Insights of Cyclopentyl trifluoroacetate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentyl trifluoroacetate. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclopentyl trifluoroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentyl trifluoroacetate has 0 hydrogen bond donor(s) and 5 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 Cyclopentyl trifluoroacetate?
The CAS number of Cyclopentyl trifluoroacetate is 703-13-9.
What is the molecular formula of Cyclopentyl trifluoroacetate?
The molecular formula of Cyclopentyl trifluoroacetate is C7H9F3O2.
What is the molecular weight of Cyclopentyl trifluoroacetate?
The molecular weight of Cyclopentyl trifluoroacetate is 182.06 g/mol.
Where can I buy Cyclopentyl trifluoroacetate?
You can request a quote for Cyclopentyl trifluoroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentyl trifluoroacetate?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentyl trifluoroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.