(4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate
TL;DR: (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate (CAS 338395-26-9) is a chemical compound with molecular formula C16H13ClN2O5 and molecular weight 348.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate
Also Known As: 4-chlorophenyl 3-{[(4-nitrobenzyl)oxy]imino}propanoate, (4-chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate
| Molecular Formula | C16H13ClN2O5 |
|---|---|
| Molecular Weight | 348.05 g/mol |
| LogP | 3.7463 |
| Topological Polar Surface Area | 91.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 348.0513 |
| Heavy Atoms | 24 |
| Complexity | 729.13794 |
Chemical Identifiers
| CAS Number | 338395-26-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CON=CCC(=O)OC2=CC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
(4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate (CAS 338395-26-9), with molecular formula C16H13ClN2O5 and molecular weight 348.05 g/mol. IUPAC: (4-chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate.
Chemical Property Profile of (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate
Property Insights of (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate
The XLogP value of 3.7463 indicates that (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.03 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate. Following Lipinski's Rule of Five, (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate has 0 hydrogen bond donor(s) and 6 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-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate?
The CAS number of (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate is 338395-26-9.
What is the molecular formula of (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate?
The molecular formula of (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate is C16H13ClN2O5.
What is the molecular weight of (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate?
The molecular weight of (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate is 348.05 g/mol.
Where can I buy (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate?
You can request a quote for (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Chlorophenyl) 3-[(4-nitrophenyl)methoxyimino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.