1-Bromo-5-methoxy-2,4-dinitrobenzene
TL;DR: 1-Bromo-5-methoxy-2,4-dinitrobenzene (CAS 181995-71-1) is a chemical compound with molecular formula C7H5BrN2O5 and molecular weight 275.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-5-methoxy-2,4-dinitrobenzene
Also Known As: 1-bromo-5-methoxy-2,4-dinitrobenzene, Erodoxin, 1-bromo-5-methoxy-2,4-dinitro-benzene, 5-bromo-2,4-dinitro-anisole, J3.775.890F
| Molecular Formula | C7H5BrN2O5 |
|---|---|
| Molecular Weight | 275.94 g/mol |
| LogP | 2.2741 |
| Topological Polar Surface Area | 95.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.93817 |
| Heavy Atoms | 15 |
| Complexity | 433.63388 |
Chemical Identifiers
| CAS Number | 181995-71-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Br |
Product Overview
1-Bromo-5-methoxy-2,4-dinitrobenzene (CAS 181995-71-1), with molecular formula C7H5BrN2O5 and molecular weight 275.94 g/mol. IUPAC: 1-bromo-5-methoxy-2,4-dinitrobenzene.
Chemical Property Profile of 1-Bromo-5-methoxy-2,4-dinitrobenzene
Property Insights of 1-Bromo-5-methoxy-2,4-dinitrobenzene
The XLogP value of 2.2741 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-5-methoxy-2,4-dinitrobenzene. The TPSA of 95.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Bromo-5-methoxy-2,4-dinitrobenzene. Following Lipinski's Rule of Five, 1-Bromo-5-methoxy-2,4-dinitrobenzene 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 1-Bromo-5-methoxy-2,4-dinitrobenzene?
The CAS number of 1-Bromo-5-methoxy-2,4-dinitrobenzene is 181995-71-1.
What is the molecular formula of 1-Bromo-5-methoxy-2,4-dinitrobenzene?
The molecular formula of 1-Bromo-5-methoxy-2,4-dinitrobenzene is C7H5BrN2O5.
What is the molecular weight of 1-Bromo-5-methoxy-2,4-dinitrobenzene?
The molecular weight of 1-Bromo-5-methoxy-2,4-dinitrobenzene is 275.94 g/mol.
Where can I buy 1-Bromo-5-methoxy-2,4-dinitrobenzene?
You can request a quote for 1-Bromo-5-methoxy-2,4-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-5-methoxy-2,4-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-5-methoxy-2,4-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.