N-(4-Chlorobenzylidene)-O-toluidine
TL;DR: N-(4-Chlorobenzylidene)-O-toluidine (CAS 33630-00-1) is a chemical compound with molecular formula C14H12ClN and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-N-(2-methylphenyl)methanimine
Also Known As: 4-chlorobenzal-2-toluidine, N-(4-CHLOROBENZYLIDENE)-O-TOLUIDINE, 1-(4-chlorophenyl)-N-(2-methylphenyl)methanimine, 2-Methyl-N-(4-chlorobenzylidene)aniline, J1.596.328J
| Molecular Formula | C14H12ClN |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 4.39902 |
| Topological Polar Surface Area | 12.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.06583 |
| Heavy Atoms | 16 |
| Complexity | 500.3987 |
Chemical Identifiers
| CAS Number | 33630-00-1 |
|---|---|
| SMILES | CC1=CC=CC=C1N=CC2=CC=C(C=C2)Cl |
Product Overview
N-(4-Chlorobenzylidene)-O-toluidine (CAS 33630-00-1), with molecular formula C14H12ClN and molecular weight 229.07 g/mol. IUPAC: 1-(4-chlorophenyl)-N-(2-methylphenyl)methanimine.
Chemical Property Profile of N-(4-Chlorobenzylidene)-O-toluidine
Property Insights of N-(4-Chlorobenzylidene)-O-toluidine
The XLogP value of 4.39902 indicates that N-(4-Chlorobenzylidene)-O-toluidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.36 Ų, N-(4-Chlorobenzylidene)-O-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Chlorobenzylidene)-O-toluidine has 0 hydrogen bond donor(s) and 1 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 N-(4-Chlorobenzylidene)-O-toluidine?
The CAS number of N-(4-Chlorobenzylidene)-O-toluidine is 33630-00-1.
What is the molecular formula of N-(4-Chlorobenzylidene)-O-toluidine?
The molecular formula of N-(4-Chlorobenzylidene)-O-toluidine is C14H12ClN.
What is the molecular weight of N-(4-Chlorobenzylidene)-O-toluidine?
The molecular weight of N-(4-Chlorobenzylidene)-O-toluidine is 229.07 g/mol.
Where can I buy N-(4-Chlorobenzylidene)-O-toluidine?
You can request a quote for N-(4-Chlorobenzylidene)-O-toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Chlorobenzylidene)-O-toluidine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chlorobenzylidene)-O-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.