![Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate structure](/static/products/6000/6000-18-6.webp)
Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate
TL;DR: Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate (CAS 6000-18-6) is a chemical compound with molecular formula C19H24FNO3 and molecular weight 333.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-2-[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate
Also Known As: BIM-0048796.P001, Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate, ethyl 2-cyano-2-[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate, ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyltetrahydro-2H-pyran-4-yl]acetate
| Molecular Formula | C19H24FNO3 |
|---|---|
| Molecular Weight | 333.17 g/mol |
| LogP | 3.74548 |
| Topological Polar Surface Area | 59.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.174 |
| Heavy Atoms | 24 |
| Complexity | 624.4942 |
Chemical Identifiers
| CAS Number | 6000-18-6 |
|---|---|
| SMILES | CCC1(CC(CCO1)(C2=CC=C(C=C2)F)C(C#N)C(=O)OCC)C |
Product Overview
Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate (CAS 6000-18-6), with molecular formula C19H24FNO3 and molecular weight 333.17 g/mol. IUPAC: ethyl 2-cyano-2-[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate.
Chemical Property Profile of Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate
Property Insights of Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate
The XLogP value of 3.74548 indicates that Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.32 Ų, Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate 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 Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate?
The CAS number of Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate is 6000-18-6.
What is the molecular formula of Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate?
The molecular formula of Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate is C19H24FNO3.
What is the molecular weight of Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate?
The molecular weight of Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate is 333.17 g/mol.
Where can I buy Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate?
You can request a quote for Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl cyano[2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.