3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde
TL;DR: 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde (CAS 792945-77-8) is a chemical compound with molecular formula C15H11BrN2O7 and molecular weight 409.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde
Also Known As: 3-bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde, 3-bromo-4-(2,4-dinitrophenoxy)-5-ethoxy-benzaldehyde, 4-(2,4-dinitrophenoxy)-3-bromo-5-ethoxybenzaldehyde, 3-Bromo-4-(2,4-dinitro-phenoxy)-5-ethoxy-benzaldehyde, C15H11BrN2O7
| Molecular Formula | C15H11BrN2O7 |
|---|---|
| Molecular Weight | 409.97 g/mol |
| LogP | 4.269 |
| Topological Polar Surface Area | 121.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.97495 |
| Heavy Atoms | 25 |
| Complexity | 854.0138 |
Chemical Identifiers
| CAS Number | 792945-77-8 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C=O)Br)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde (CAS 792945-77-8), with molecular formula C15H11BrN2O7 and molecular weight 409.97 g/mol. IUPAC: 3-bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde.
Chemical Property Profile of 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde
Property Insights of 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde
The XLogP value of 4.269 indicates that 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde. Following Lipinski's Rule of Five, 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde has 0 hydrogen bond donor(s) and 7 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 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde?
The CAS number of 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde is 792945-77-8.
What is the molecular formula of 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde?
The molecular formula of 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde is C15H11BrN2O7.
What is the molecular weight of 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde?
The molecular weight of 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde is 409.97 g/mol.
Where can I buy 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde?
You can request a quote for 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-4-(2,4-dinitrophenoxy)-5-ethoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.