2-(2-Butoxyethoxy)ethyl trichloroacetate
TL;DR: 2-(2-Butoxyethoxy)ethyl trichloroacetate (CAS 31023-42-4) is a chemical compound with molecular formula C10H17Cl3O4 and molecular weight 306.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-butoxyethoxy)ethyl 2,2,2-trichloroacetate
Also Known As: 2-(2-butoxyethoxy)ethyl trichloroacetate, 2-(2-butoxyethoxy)ethyl 2,2,2-trichloroacetate, Acetic acid,2,2,2-trichloro-, 2-(2-butoxyethoxy)ethyl ester, RefChem:250524
| Molecular Formula | C10H17Cl3O4 |
|---|---|
| Molecular Weight | 306.02 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 306.01926 |
| Heavy Atoms | 17 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 31023-42-4 |
|---|---|
| SMILES | CCCCOCCOCCOC(=O)C(Cl)(Cl)Cl |
| InChIKey | AZPYYJUMRUGYJM-UHFFFAOYSA-N |
Product Overview
2-(2-Butoxyethoxy)ethyl trichloroacetate (CAS 31023-42-4), with molecular formula C10H17Cl3O4 and molecular weight 306.02 g/mol. IUPAC: 2-(2-butoxyethoxy)ethyl 2,2,2-trichloroacetate.
Chemical Property Profile of 2-(2-Butoxyethoxy)ethyl trichloroacetate
Property Insights of 2-(2-Butoxyethoxy)ethyl trichloroacetate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Butoxyethoxy)ethyl trichloroacetate. With a topological polar surface area (TPSA) of 44.8 Ų, 2-(2-Butoxyethoxy)ethyl trichloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Butoxyethoxy)ethyl trichloroacetate has 0 hydrogen bond donor(s) and 4 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-Butoxyethoxy)ethyl trichloroacetate?
The CAS number of 2-(2-Butoxyethoxy)ethyl trichloroacetate is 31023-42-4.
What is the molecular formula of 2-(2-Butoxyethoxy)ethyl trichloroacetate?
The molecular formula of 2-(2-Butoxyethoxy)ethyl trichloroacetate is C10H17Cl3O4.
What is the molecular weight of 2-(2-Butoxyethoxy)ethyl trichloroacetate?
The molecular weight of 2-(2-Butoxyethoxy)ethyl trichloroacetate is 306.02 g/mol.
Where can I buy 2-(2-Butoxyethoxy)ethyl trichloroacetate?
You can request a quote for 2-(2-Butoxyethoxy)ethyl trichloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Butoxyethoxy)ethyl trichloroacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Butoxyethoxy)ethyl trichloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.