2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime
TL;DR: 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime (CAS 451485-70-4) is a chemical compound with molecular formula C13H9ClFNO2 and molecular weight 265.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(4-chloro-3-fluorophenoxy)phenyl]methylidene]hydroxylamine
Also Known As: Bionet2_000414, 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime, N-{[2-(4-chloro-3-fluorophenoxy)phenyl]methylidene}hydroxylamine, 2-(4-chloro-3-fluorophenoxy)benzenecarbaldehyde oxime, N-[[2-(4-chloro-3-fluorophenoxy)phenyl]methylidene]hydroxylamine
| Molecular Formula | C13H9ClFNO2 |
|---|---|
| Molecular Weight | 265.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.03058 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 451485-70-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NO)OC2=CC(=C(C=C2)Cl)F |
| InChIKey | VGQLDYWJGIQJRP-UHFFFAOYSA-N |
Product Overview
2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime (CAS 451485-70-4), with molecular formula C13H9ClFNO2 and molecular weight 265.03 g/mol. IUPAC: N-[[2-(4-chloro-3-fluorophenoxy)phenyl]methylidene]hydroxylamine.
Chemical Property Profile of 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime
Property Insights of 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime
The XLogP value of 3.9 indicates that 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.8 Ų, 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime has 1 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 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime?
The CAS number of 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime is 451485-70-4.
What is the molecular formula of 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime?
The molecular formula of 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime is C13H9ClFNO2.
What is the molecular weight of 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime?
The molecular weight of 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime is 265.03 g/mol.
Where can I buy 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime?
You can request a quote for 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-3-fluorophenoxy)benzaldehyde oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.