4-Chloro-3,5-dinitrophenacylbromide
TL;DR: 4-Chloro-3,5-dinitrophenacylbromide (CAS 37699-28-8) is a chemical compound with molecular formula C8H4BrClN2O5 and molecular weight 321.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(4-chloro-3,5-dinitrophenyl)ethanone
Also Known As: 4-Chloro-3,5-dinitrophenacylbromide, 4-chloro-3,5-dinitrophenacyl bromide, 2-bromo-1-(4-chloro-3,5-dinitrophenyl)ethanone, Ethanone, 2-bromo-1-(4-chloro-3,5-dinitrophenyl)-, 2-Bromo-1-(4-chloro-3,5-dinitrophenyl)ethan-1-one
| Molecular Formula | C8H4BrClN2O5 |
|---|---|
| Molecular Weight | 321.90 g/mol |
| LogP | 2.734 |
| Topological Polar Surface Area | 103.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.8992 |
| Heavy Atoms | 17 |
| Complexity | 483.63217 |
Chemical Identifiers
| CAS Number | 37699-28-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(=O)CBr |
Product Overview
4-Chloro-3,5-dinitrophenacylbromide (CAS 37699-28-8), with molecular formula C8H4BrClN2O5 and molecular weight 321.90 g/mol. IUPAC: 2-bromo-1-(4-chloro-3,5-dinitrophenyl)ethanone.
Chemical Property Profile of 4-Chloro-3,5-dinitrophenacylbromide
Property Insights of 4-Chloro-3,5-dinitrophenacylbromide
The XLogP value of 2.734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-3,5-dinitrophenacylbromide. The TPSA of 103.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3,5-dinitrophenacylbromide. Following Lipinski's Rule of Five, 4-Chloro-3,5-dinitrophenacylbromide 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 4-Chloro-3,5-dinitrophenacylbromide?
The CAS number of 4-Chloro-3,5-dinitrophenacylbromide is 37699-28-8.
What is the molecular formula of 4-Chloro-3,5-dinitrophenacylbromide?
The molecular formula of 4-Chloro-3,5-dinitrophenacylbromide is C8H4BrClN2O5.
What is the molecular weight of 4-Chloro-3,5-dinitrophenacylbromide?
The molecular weight of 4-Chloro-3,5-dinitrophenacylbromide is 321.90 g/mol.
Where can I buy 4-Chloro-3,5-dinitrophenacylbromide?
You can request a quote for 4-Chloro-3,5-dinitrophenacylbromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3,5-dinitrophenacylbromide?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3,5-dinitrophenacylbromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.