Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate
TL;DR: Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate (CAS 119124-16-2) is a chemical compound with molecular formula C7H8F3NO4 and molecular weight 227.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate
Also Known As: ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate, ethyl 4,4,4-trifluoro-2-(methoxyimino)-3-oxobutanoate
| Molecular Formula | C7H8F3NO4 |
|---|---|
| Molecular Weight | 227.04 g/mol |
| LogP | 0.6833 |
| Topological Polar Surface Area | 64.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.04054 |
| Heavy Atoms | 15 |
| Complexity | 284.4501 |
Chemical Identifiers
| CAS Number | 119124-16-2 |
|---|---|
| SMILES | CCOC(=O)C(=NOC)C(=O)C(F)(F)F |
Product Overview
Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate (CAS 119124-16-2), with molecular formula C7H8F3NO4 and molecular weight 227.04 g/mol. IUPAC: ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate.
Chemical Property Profile of Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate
Property Insights of Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate
The XLogP value of 0.6833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate. The TPSA of 64.96 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate. Following Lipinski's Rule of Five, Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate 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 Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate?
The CAS number of Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate is 119124-16-2.
What is the molecular formula of Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate?
The molecular formula of Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate is C7H8F3NO4.
What is the molecular weight of Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate?
The molecular weight of Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate is 227.04 g/mol.
Where can I buy Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate?
You can request a quote for Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4,4,4-trifluoro-2-methoxyimino-3-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.