![4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate structure](/static/products/3314/331460-65-2.webp)
4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate
TL;DR: 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate (CAS 331460-65-2) is a chemical compound with molecular formula C21H15FN2O4 and molecular weight 378.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(4-fluoro-3-nitrophenyl)iminomethyl]phenyl] 4-methylbenzoate
Also Known As: 4-{[(4-fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate, [4-[(4-fluoro-3-nitrophenyl)iminomethyl]phenyl] 4-methylbenzoate, 4-[(1E)-[(4-fluoro-3-nitrophenyl)imino]methyl]phenyl 4-methylbenzoate, 4-[(1E)-[(4-fluoro-3-nitrophenyl)imino]methyl]phenyl4-methylbenzoate, 4-{(4-Fluoro-3-nitrophenyl)iminomethyl}phenyl 4-methylbenzenecarboxylate
| Molecular Formula | C21H15FN2O4 |
|---|---|
| Molecular Weight | 378.10 g/mol |
| LogP | 5.01212 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.1016 |
| Heavy Atoms | 28 |
| Complexity | 1045.0056 |
Chemical Identifiers
| CAS Number | 331460-65-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NC3=CC(=C(C=C3)F)[N+](=O)[O-] |
Product Overview
4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate (CAS 331460-65-2), with molecular formula C21H15FN2O4 and molecular weight 378.10 g/mol. IUPAC: [4-[(4-fluoro-3-nitrophenyl)iminomethyl]phenyl] 4-methylbenzoate.
Chemical Property Profile of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate
Property Insights of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate
The XLogP value of 5.01212 indicates that 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate. Following Lipinski's Rule of Five, 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate?
The CAS number of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate is 331460-65-2.
What is the molecular formula of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate?
The molecular formula of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate is C21H15FN2O4.
What is the molecular weight of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate?
The molecular weight of 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate is 378.10 g/mol.
Where can I buy 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate?
You can request a quote for 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(4-Fluoro-3-nitrophenyl)imino]methyl}phenyl 4-methylbenzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.