3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde
TL;DR: 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde (CAS 591240-92-5) is a chemical compound with molecular formula C14H9BrN2O7 and molecular weight 395.96 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-methoxybenzaldehyde
Also Known As: 3-bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde, 3-bromo-4-(2,4-dinitrophenoxy)-5-methoxy-benzaldehyde, 4-(2,4-dinitrophenoxy)-3-bromo-5-methoxybenzaldehyde, 3-Bromo-4-(2,4-dinitro-phenoxy)-5-methoxy-benzaldehyde, C14H9BrN2O7
| Molecular Formula | C14H9BrN2O7 |
|---|---|
| Molecular Weight | 395.96 g/mol |
| LogP | 3.8789 |
| Topological Polar Surface Area | 121.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.95932 |
| Heavy Atoms | 24 |
| Complexity | 838.1129 |
Chemical Identifiers
| CAS Number | 591240-92-5 |
|---|---|
| SMILES | COC1=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-methoxybenzaldehyde (CAS 591240-92-5), with molecular formula C14H9BrN2O7 and molecular weight 395.96 g/mol. IUPAC: 3-bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde.
Chemical Property Profile of 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde
Property Insights of 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde
The XLogP value of 3.8789 indicates that 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde 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-methoxybenzaldehyde. Following Lipinski's Rule of Five, 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde 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-methoxybenzaldehyde?
The CAS number of 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde is 591240-92-5.
What is the molecular formula of 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde?
The molecular formula of 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde is C14H9BrN2O7.
What is the molecular weight of 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde?
The molecular weight of 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde is 395.96 g/mol.
Where can I buy 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde?
You can request a quote for 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde 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-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.