![7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one structure](/static/products/4428/442871-16-1.webp)
7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
TL;DR: 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one (CAS 442871-16-1) is a chemical compound with molecular formula C19H10Cl2N2O5 and molecular weight 416.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
Also Known As: 1-(2,3-dichlorophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one, A2587/0110206, 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one, 1-(2,3-dichlorophenoxy)-3-nitro-10H-dibenzo[b,f]1,4-oxazepin-11-one
| Molecular Formula | C19H10Cl2N2O5 |
|---|---|
| Molecular Weight | 416.00 g/mol |
| LogP | 6.0519 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.99667 |
| Heavy Atoms | 28 |
| Complexity | 1133.302 |
Chemical Identifiers
| CAS Number | 442871-16-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=O)C3=C(O2)C=C(C=C3OC4=C(C(=CC=C4)Cl)Cl)[N+](=O)[O-] |
Product Overview
7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one (CAS 442871-16-1), with molecular formula C19H10Cl2N2O5 and molecular weight 416.00 g/mol. IUPAC: 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one.
Chemical Property Profile of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
Property Insights of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
The XLogP value of 6.0519 indicates that 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one. Following Lipinski's Rule of Five, 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one?
The CAS number of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one is 442871-16-1.
What is the molecular formula of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one?
The molecular formula of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one is C19H10Cl2N2O5.
What is the molecular weight of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one?
The molecular weight of 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one is 416.00 g/mol.
Where can I buy 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one?
You can request a quote for 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 7-(2,3-dichlorophenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.