Chloronitrobenzofuroxane
TL;DR: Chloronitrobenzofuroxane (CAS 18378-14-8) is a chemical compound with molecular formula C6H2ClN3O4 and molecular weight 214.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-4-nitro-1-oxido-2,1,3-benzoxadiazol-1-ium
Also Known As: chloronitrobenzofuroxane, 4-Nitro-5-chlorobenzofuroxane, AB00073859-01, 5-chloro-4-nitro-1-oxido-2,1,3-benzoxadiazol-1-ium
| Molecular Formula | C6H2ClN3O4 |
|---|---|
| Molecular Weight | 214.97 g/mol |
| LogP | 1.0228 |
| Topological Polar Surface Area | 96.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.97339 |
| Heavy Atoms | 14 |
| Complexity | 523.0161 |
Chemical Identifiers
| CAS Number | 18378-14-8 |
|---|---|
| SMILES | C1=CC2=[N+](ON=C2C(=C1Cl)[N+](=O)[O-])[O-] |
Product Overview
Chloronitrobenzofuroxane (CAS 18378-14-8), with molecular formula C6H2ClN3O4 and molecular weight 214.97 g/mol. IUPAC: 5-chloro-4-nitro-1-oxido-2,1,3-benzoxadiazol-1-ium.
Chemical Property Profile of Chloronitrobenzofuroxane
Property Insights of Chloronitrobenzofuroxane
The XLogP value of 1.0228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloronitrobenzofuroxane. The TPSA of 96.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Chloronitrobenzofuroxane. Following Lipinski's Rule of Five, Chloronitrobenzofuroxane 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 Chloronitrobenzofuroxane?
The CAS number of Chloronitrobenzofuroxane is 18378-14-8.
What is the molecular formula of Chloronitrobenzofuroxane?
The molecular formula of Chloronitrobenzofuroxane is C6H2ClN3O4.
What is the molecular weight of Chloronitrobenzofuroxane?
The molecular weight of Chloronitrobenzofuroxane is 214.97 g/mol.
Where can I buy Chloronitrobenzofuroxane?
You can request a quote for Chloronitrobenzofuroxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloronitrobenzofuroxane?
Yes, KEHONG BIO provides custom synthesis services for Chloronitrobenzofuroxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.