4-Chloro-1-nitro-2-(2-nitroethenyl)benzene
TL;DR: 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene (CAS 73688-91-2) is a chemical compound with molecular formula C8H5ClN2O4 and molecular weight 227.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-nitro-2-(2-nitroethenyl)benzene
Also Known As: 5-Chloro-beta,2-dinitro-styrene, 2-Nitro-5-cloro-beta-nitrostirene, Styrene, 5-chloro-beta,2-dinitro-, 5-CHLORO-2,OMEGA-DINITROSTYRENE, 4-Chloro-1-nitro-2-(2-nitrovinyl)benzene
| Molecular Formula | C8H5ClN2O4 |
|---|---|
| Molecular Weight | 227.99 g/mol |
| LogP | 2.4956 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.99379 |
| Heavy Atoms | 15 |
| Complexity | 444.26785 |
Chemical Identifiers
| CAS Number | 73688-91-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)C=C[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
4-Chloro-1-nitro-2-(2-nitroethenyl)benzene (CAS 73688-91-2), with molecular formula C8H5ClN2O4 and molecular weight 227.99 g/mol. IUPAC: 4-chloro-1-nitro-2-(2-nitroethenyl)benzene.
Chemical Property Profile of 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene
Property Insights of 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene
The XLogP value of 2.4956 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene. Following Lipinski's Rule of Five, 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene has 0 hydrogen bond donor(s) and 4 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-Chloro-1-nitro-2-(2-nitroethenyl)benzene?
The CAS number of 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene is 73688-91-2.
What is the molecular formula of 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene?
The molecular formula of 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene is C8H5ClN2O4.
What is the molecular weight of 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene?
The molecular weight of 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene is 227.99 g/mol.
Where can I buy 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene?
You can request a quote for 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-1-nitro-2-(2-nitroethenyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.