![1-[Methoxy(dinitro)methyl]-4-nitrobenzene structure](/static/products/137/137729-75-0.png)
1-[Methoxy(dinitro)methyl]-4-nitrobenzene
TL;DR: 1-[Methoxy(dinitro)methyl]-4-nitrobenzene (CAS 137729-75-0) is a chemical compound with molecular formula C8H7N3O7 and molecular weight 257.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[methoxy(dinitro)methyl]-4-nitrobenzene
Also Known As: 1-[methoxy(dinitro)methyl]-4-nitrobenzene, 1-(methoxydinitromethyl)-4-nitrobenzene, 1-(methoxy-dinitro-methyl)-4-nitro-benzene
| Molecular Formula | C8H7N3O7 |
|---|---|
| Molecular Weight | 257.03 g/mol |
| LogP | 0.9049 |
| Topological Polar Surface Area | 138.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.0284 |
| Heavy Atoms | 18 |
| Complexity | 483.917 |
Chemical Identifiers
| CAS Number | 137729-75-0 |
|---|---|
| SMILES | COC(C1=CC=C(C=C1)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1-[Methoxy(dinitro)methyl]-4-nitrobenzene (CAS 137729-75-0), with molecular formula C8H7N3O7 and molecular weight 257.03 g/mol. IUPAC: 1-[methoxy(dinitro)methyl]-4-nitrobenzene.
Chemical Property Profile of 1-[Methoxy(dinitro)methyl]-4-nitrobenzene
Property Insights of 1-[Methoxy(dinitro)methyl]-4-nitrobenzene
The XLogP value of 0.9049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[Methoxy(dinitro)methyl]-4-nitrobenzene. The TPSA of 138.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[Methoxy(dinitro)methyl]-4-nitrobenzene. Following Lipinski's Rule of Five, 1-[Methoxy(dinitro)methyl]-4-nitrobenzene 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 1-[Methoxy(dinitro)methyl]-4-nitrobenzene?
The CAS number of 1-[Methoxy(dinitro)methyl]-4-nitrobenzene is 137729-75-0.
What is the molecular formula of 1-[Methoxy(dinitro)methyl]-4-nitrobenzene?
The molecular formula of 1-[Methoxy(dinitro)methyl]-4-nitrobenzene is C8H7N3O7.
What is the molecular weight of 1-[Methoxy(dinitro)methyl]-4-nitrobenzene?
The molecular weight of 1-[Methoxy(dinitro)methyl]-4-nitrobenzene is 257.03 g/mol.
Where can I buy 1-[Methoxy(dinitro)methyl]-4-nitrobenzene?
You can request a quote for 1-[Methoxy(dinitro)methyl]-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[Methoxy(dinitro)methyl]-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[Methoxy(dinitro)methyl]-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.