4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde
TL;DR: 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde (CAS 876708-56-4) is a chemical compound with molecular formula C15H13NO5 and molecular weight 287.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde
Also Known As: 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde, 4-Methoxy-3-((4-nitrophenoxy)methyl)benzaldehyde, ZERO/004745, 4-methoxy-3-(4-nitrophenoxymethyl)benzaldehyde, 4-Methoxy-3-(4-nitro-phenoxymethyl)benzaldehyde
| Molecular Formula | C15H13NO5 |
|---|---|
| Molecular Weight | 287.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.07938 |
| Heavy Atoms | 21 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 876708-56-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=O)COC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | CEIJZCASKXSWHG-UHFFFAOYSA-N |
Product Overview
4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde (CAS 876708-56-4), with molecular formula C15H13NO5 and molecular weight 287.08 g/mol. IUPAC: 4-methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde.
Chemical Property Profile of 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde
Property Insights of 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde. Following Lipinski's Rule of Five, 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde 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-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde?
The CAS number of 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde is 876708-56-4.
What is the molecular formula of 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde?
The molecular formula of 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde is C15H13NO5.
What is the molecular weight of 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde?
The molecular weight of 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde is 287.08 g/mol.
Where can I buy 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde?
You can request a quote for 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-3-[(4-nitrophenoxy)methyl]benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.