Benzene, 1-iodo-3,5-dinitro-2-phenoxy-
TL;DR: Benzene, 1-iodo-3,5-dinitro-2-phenoxy- (CAS 89563-22-4) is a chemical compound with molecular formula C12H7IN2O5 and molecular weight 385.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-iodo-3,5-dinitro-2-phenoxybenzene
Also Known As: Benzene, 1-iodo-3,5-dinitro-2-phenoxy-, 1-iodo-3,5-dinitro-2-phenoxybenzene, AP-915/40882328, RefChem:323758
| Molecular Formula | C12H7IN2O5 |
|---|---|
| Molecular Weight | 385.94 g/mol |
| LogP | 3.8999 |
| Topological Polar Surface Area | 95.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.93997 |
| Heavy Atoms | 20 |
| Complexity | 675.0479 |
Chemical Identifiers
| CAS Number | 89563-22-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=C(C=C(C=C2I)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
Benzene, 1-iodo-3,5-dinitro-2-phenoxy- (CAS 89563-22-4), with molecular formula C12H7IN2O5 and molecular weight 385.94 g/mol. IUPAC: 1-iodo-3,5-dinitro-2-phenoxybenzene.
Chemical Property Profile of Benzene, 1-iodo-3,5-dinitro-2-phenoxy-
Property Insights of Benzene, 1-iodo-3,5-dinitro-2-phenoxy-
The XLogP value of 3.8999 indicates that Benzene, 1-iodo-3,5-dinitro-2-phenoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1-iodo-3,5-dinitro-2-phenoxy-. Following Lipinski's Rule of Five, Benzene, 1-iodo-3,5-dinitro-2-phenoxy- 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 Benzene, 1-iodo-3,5-dinitro-2-phenoxy-?
The CAS number of Benzene, 1-iodo-3,5-dinitro-2-phenoxy- is 89563-22-4.
What is the molecular formula of Benzene, 1-iodo-3,5-dinitro-2-phenoxy-?
The molecular formula of Benzene, 1-iodo-3,5-dinitro-2-phenoxy- is C12H7IN2O5.
What is the molecular weight of Benzene, 1-iodo-3,5-dinitro-2-phenoxy-?
The molecular weight of Benzene, 1-iodo-3,5-dinitro-2-phenoxy- is 385.94 g/mol.
Where can I buy Benzene, 1-iodo-3,5-dinitro-2-phenoxy-?
You can request a quote for Benzene, 1-iodo-3,5-dinitro-2-phenoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-iodo-3,5-dinitro-2-phenoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-iodo-3,5-dinitro-2-phenoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.