![[(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate structure](/static/products/2535/253586-38-8.webp)
[(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate
TL;DR: [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate (CAS 253586-38-8) is a chemical compound with molecular formula C9H6Cl2FNO2 and molecular weight 248.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3-chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate
Also Known As: 2-chloro-4-({[(2-chloroacetyl)oxy]imino}methyl)-1-fluorobenzene, [(3-chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate
| Molecular Formula | C9H6Cl2FNO2 |
|---|---|
| Molecular Weight | 248.98 g/mol |
| LogP | 2.595 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.97597 |
| Heavy Atoms | 15 |
| Complexity | 395.69876 |
Chemical Identifiers
| CAS Number | 253586-38-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1C=NOC(=O)CCl)Cl)F |
Product Overview
[(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate (CAS 253586-38-8), with molecular formula C9H6Cl2FNO2 and molecular weight 248.98 g/mol. IUPAC: [(3-chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate.
Chemical Property Profile of [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate
Property Insights of [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate
The XLogP value of 2.595 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate. With a topological polar surface area (TPSA) of 38.66 Ų, [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate has 0 hydrogen bond donor(s) and 3 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 [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate?
The CAS number of [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate is 253586-38-8.
What is the molecular formula of [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate?
The molecular formula of [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate is C9H6Cl2FNO2.
What is the molecular weight of [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate?
The molecular weight of [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate is 248.98 g/mol.
Where can I buy [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate?
You can request a quote for [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for [(3-Chloro-4-fluorophenyl)methylideneamino] 2-chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.