![3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine structure](/static/products/3092/309272-32-0.webp)
3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine
TL;DR: 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine (CAS 309272-32-0) is a chemical compound with molecular formula C14H7ClN2O5 and molecular weight 318.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-7,9-dinitrobenzo[b][1]benzoxepine
Also Known As: 8-chloro-1,3-dinitrodibenzo[b,f]oxepin, 8-chloro-1,3-dinitrodibenzo[b,f]oxepine, 3-chloro-7,9-dinitrobenzo[b][1]benzoxepine, 8-Chloro-1,3-dinitro-dibenzo[b,f]oxepine, A2075/0087222
| Molecular Formula | C14H7ClN2O5 |
|---|---|
| Molecular Weight | 318.00 g/mol |
| LogP | 4.4325 |
| Topological Polar Surface Area | 95.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.00436 |
| Heavy Atoms | 22 |
| Complexity | 847.3671 |
Chemical Identifiers
| CAS Number | 309272-32-0 |
|---|---|
| SMILES | C1=CC2=C(C=CC3=C(C=C(C=C3O2)[N+](=O)[O-])[N+](=O)[O-])C=C1Cl |
Product Overview
3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine (CAS 309272-32-0), with molecular formula C14H7ClN2O5 and molecular weight 318.00 g/mol. IUPAC: 3-chloro-7,9-dinitrobenzo[b][1]benzoxepine.
Chemical Property Profile of 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine
Property Insights of 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine
The XLogP value of 4.4325 indicates that 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine 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 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine. Following Lipinski's Rule of Five, 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine 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 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine?
The CAS number of 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine is 309272-32-0.
What is the molecular formula of 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine?
The molecular formula of 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine is C14H7ClN2O5.
What is the molecular weight of 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine?
The molecular weight of 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine is 318.00 g/mol.
Where can I buy 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine?
You can request a quote for 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-7,9-dinitrobenzo[b][1]benzoxepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.