1,2,3-Trimethoxy-4-nitrobenzene
TL;DR: 1,2,3-Trimethoxy-4-nitrobenzene (CAS 102872-41-3) is a chemical compound with molecular formula C9H11NO5 and molecular weight 213.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3-trimethoxy-4-nitrobenzene
Also Known As: 1,2,3-trimethoxy-4-nitrobenzene, trimethoxynitrobenzene, AP-065/41884100
| Molecular Formula | C9H11NO5 |
|---|---|
| Molecular Weight | 213.06 g/mol |
| LogP | 1.6206 |
| Topological Polar Surface Area | 70.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 213.06372 |
| Heavy Atoms | 15 |
| Complexity | 377.01062 |
Chemical Identifiers
| CAS Number | 102872-41-3 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)OC |
Product Overview
1,2,3-Trimethoxy-4-nitrobenzene (CAS 102872-41-3), with molecular formula C9H11NO5 and molecular weight 213.06 g/mol. IUPAC: 1,2,3-trimethoxy-4-nitrobenzene.
Chemical Property Profile of 1,2,3-Trimethoxy-4-nitrobenzene
Property Insights of 1,2,3-Trimethoxy-4-nitrobenzene
The XLogP value of 1.6206 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3-Trimethoxy-4-nitrobenzene. The TPSA of 70.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3-Trimethoxy-4-nitrobenzene. Following Lipinski's Rule of Five, 1,2,3-Trimethoxy-4-nitrobenzene 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 1,2,3-Trimethoxy-4-nitrobenzene?
The CAS number of 1,2,3-Trimethoxy-4-nitrobenzene is 102872-41-3.
What is the molecular formula of 1,2,3-Trimethoxy-4-nitrobenzene?
The molecular formula of 1,2,3-Trimethoxy-4-nitrobenzene is C9H11NO5.
What is the molecular weight of 1,2,3-Trimethoxy-4-nitrobenzene?
The molecular weight of 1,2,3-Trimethoxy-4-nitrobenzene is 213.06 g/mol.
Where can I buy 1,2,3-Trimethoxy-4-nitrobenzene?
You can request a quote for 1,2,3-Trimethoxy-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Trimethoxy-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Trimethoxy-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.