![4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione structure](/static/products/832/832136-17-1.png)
4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione
TL;DR: 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione (CAS 832136-17-1) is a chemical compound with molecular formula C18H13F3N2O7 and molecular weight 426.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione
Also Known As: 4,5-dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione, 4,5-dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C18H13F3N2O7 |
|---|---|
| Molecular Weight | 426.07 g/mol |
| LogP | 3.3537 |
| Topological Polar Surface Area | 108.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.06747 |
| Heavy Atoms | 30 |
| Complexity | 1052.806 |
Chemical Identifiers
| CAS Number | 832136-17-1 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C(=O)N(C2=O)C3=CC(=CC(=C3)OCC(F)(F)F)[N+](=O)[O-])OC |
Product Overview
4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione (CAS 832136-17-1), with molecular formula C18H13F3N2O7 and molecular weight 426.07 g/mol. IUPAC: 4,5-dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione.
Chemical Property Profile of 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione
Property Insights of 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione
The XLogP value of 3.3537 indicates that 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione. Following Lipinski's Rule of Five, 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione 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 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione?
The CAS number of 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione is 832136-17-1.
What is the molecular formula of 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione?
The molecular formula of 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione is C18H13F3N2O7.
What is the molecular weight of 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione?
The molecular weight of 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione is 426.07 g/mol.
Where can I buy 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione?
You can request a quote for 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethoxy-2-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.