![ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate structure](/static/products/3389/338954-29-3.webp)
ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate
TL;DR: ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate (CAS 338954-29-3) is a chemical compound with molecular formula C14H15ClN2O5 and molecular weight 326.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[[4-chloro-2-(hydroxyiminomethyl)phenoxy]methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
Also Known As: ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate, ethyl 5-[[4-chloro-2-(hydroxyiminomethyl)phenoxy]methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
| Molecular Formula | C14H15ClN2O5 |
|---|---|
| Molecular Weight | 326.07 g/mol |
| LogP | 2.2349 |
| Topological Polar Surface Area | 89.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.06696 |
| Heavy Atoms | 22 |
| Complexity | 602.89606 |
Chemical Identifiers
| CAS Number | 338954-29-3 |
|---|---|
| SMILES | CCOC(=O)C1=NOC(C1)COC2=C(C=C(C=C2)Cl)C=NO |
Product Overview
ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate (CAS 338954-29-3), with molecular formula C14H15ClN2O5 and molecular weight 326.07 g/mol. IUPAC: ethyl 5-[[4-chloro-2-(hydroxyiminomethyl)phenoxy]methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate.
Chemical Property Profile of ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate
Property Insights of ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate
The XLogP value of 2.2349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate. The TPSA of 89.71 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate. Following Lipinski's Rule of Five, ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate has 1 hydrogen bond donor(s) and 7 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 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate?
The CAS number of ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate is 338954-29-3.
What is the molecular formula of ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate?
The molecular formula of ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate is C14H15ClN2O5.
What is the molecular weight of ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate?
The molecular weight of ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate is 326.07 g/mol.
Where can I buy ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate?
You can request a quote for ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-({4-chloro-2-[(hydroxyimino)methyl]phenoxy}methyl)-4,5-dihydro-3-isoxazolecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.