![4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime structure](/static/products/4778/477851-87-9.webp)
4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime
TL;DR: 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime (CAS 477851-87-9) is a chemical compound with molecular formula C14H11ClN2O3S and molecular weight 322.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]-N-methoxymethanimine
Also Known As: 4-[(4-chlorophenyl)sulfanyl]-3-nitrobenzenecarbaldehyde O-methyloxime, 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime, 1-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]-N-methoxymethanimine, 1-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-N-methoxy-methanimine, 1-{4-[(4-Chlorophenyl)sulfanyl]-3-nitrophenyl}-N-methoxymethanimine
| Molecular Formula | C14H11ClN2O3S |
|---|---|
| Molecular Weight | 322.02 g/mol |
| LogP | 4.3797 |
| Topological Polar Surface Area | 64.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.01788 |
| Heavy Atoms | 21 |
| Complexity | 674.4194 |
Chemical Identifiers
| CAS Number | 477851-87-9 |
|---|---|
| SMILES | CON=CC1=CC(=C(C=C1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime (CAS 477851-87-9), with molecular formula C14H11ClN2O3S and molecular weight 322.02 g/mol. IUPAC: 1-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]-N-methoxymethanimine.
Chemical Property Profile of 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime
Property Insights of 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime
The XLogP value of 4.3797 indicates that 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime. Following Lipinski's Rule of Five, 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime 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 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime?
The CAS number of 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime is 477851-87-9.
What is the molecular formula of 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime?
The molecular formula of 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime is C14H11ClN2O3S.
What is the molecular weight of 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime?
The molecular weight of 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime is 322.02 g/mol.
Where can I buy 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime?
You can request a quote for 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Chlorophenyl)thio]-3-nitrobenzaldehyde O-methyloxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.