(Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide
TL;DR: (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide (CAS 691376-80-4) is a chemical compound with molecular formula C15H13F2NO2 and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)methanimine oxide
Also Known As: (NZ)-N-{[4-(DIFLUOROMETHOXY)PHENYL]METHYLIDENE}-4-METHYL-N-OXIDOANILINIUM, (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide, F1593-0041, 1-(4-(Difluoromethoxy)phenyl)-N-(p-tolyl)methanimine oxide, 1-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)methanimine oxide
| Molecular Formula | C15H13F2NO2 |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 3.85732 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.09143 |
| Heavy Atoms | 20 |
| Complexity | 592.2755 |
Chemical Identifiers
| CAS Number | 691376-80-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/[N+](=C/C2=CC=C(C=C2)OC(F)F)/[O-] |
Product Overview
(Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide (CAS 691376-80-4), with molecular formula C15H13F2NO2 and molecular weight 277.09 g/mol. IUPAC: 1-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)methanimine oxide.
Chemical Property Profile of (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide
Property Insights of (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide
The XLogP value of 3.85732 indicates that (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.3 Ų, (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide has 0 hydrogen bond donor(s) and 2 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 (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide?
The CAS number of (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide is 691376-80-4.
What is the molecular formula of (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide?
The molecular formula of (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide is C15H13F2NO2.
What is the molecular weight of (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide?
The molecular weight of (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide is 277.09 g/mol.
Where can I buy (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide?
You can request a quote for (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(4-(difluoromethoxy)benzylidene)-4-methylaniline oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.