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Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate
TL;DR: Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate (CAS 96722-60-0) is a chemical compound with molecular formula C11H7ClF6N2O2 and molecular weight 348.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate
Also Known As: Acetic Acid, Chloro((3,5-(trifluoromethyl)phenyl)hydrazono)-, Methyl Ester, METHYL (2E)-2-[[3,5-BIS(TRIFLUOROMETHYL)PHENYL]HYDRAZINYLIDENE]-2-CHLORO-ACETATE
| Molecular Formula | C11H7ClF6N2O2 |
|---|---|
| Molecular Weight | 348.01 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.01 |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 96722-60-0 |
|---|---|
| SMILES | COC(=O)C(=NNC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)Cl |
| InChIKey | UOOUZDFAUHFKEP-UHFFFAOYSA-N |
Product Overview
Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate (CAS 96722-60-0), with molecular formula C11H7ClF6N2O2 and molecular weight 348.01 g/mol. IUPAC: methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate.
Chemical Property Profile of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate
Property Insights of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate
The XLogP value of 5.9 indicates that Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.7 Ų, Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate?
The CAS number of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate is 96722-60-0.
What is the molecular formula of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate?
The molecular formula of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate is C11H7ClF6N2O2.
What is the molecular weight of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate?
The molecular weight of Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate is 348.01 g/mol.
Where can I buy Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate?
You can request a quote for Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[3,5-bis(trifluoromethyl)phenyl]hydrazinylidene]-2-chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.