Ethanone,1-(4,5-dichloro-2-nitrophenyl)-
TL;DR: Ethanone,1-(4,5-dichloro-2-nitrophenyl)- (CAS 6635-71-8) is a chemical compound with molecular formula C8H5Cl2NO3 and molecular weight 232.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dichloro-2-nitrophenyl)ethanone
Also Known As: 1-(4,5-dichloro-2-nitrophenyl)ethanone, KST-1B8388, Ethanone,1-(4,5-dichloro-2-nitrophenyl)-, 1-(4,5-dichloro-2-nitro-phenyl)-ethanone, 1-(4,5-Dichloro-2-nitrophenyl)ethan-1-one
| Molecular Formula | C8H5Cl2NO3 |
|---|---|
| Molecular Weight | 232.96 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.96465 |
| Heavy Atoms | 14 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 6635-71-8 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1[N+](=O)[O-])Cl)Cl |
| InChIKey | FRVFMCRPKGKETG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone,1-(4,5-dichloro-2-nitrophenyl)- (CAS 6635-71-8), with molecular formula C8H5Cl2NO3 and molecular weight 232.96 g/mol. IUPAC: 1-(4,5-dichloro-2-nitrophenyl)ethanone.
Chemical Property Profile of Ethanone,1-(4,5-dichloro-2-nitrophenyl)-
Property Insights of Ethanone,1-(4,5-dichloro-2-nitrophenyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone,1-(4,5-dichloro-2-nitrophenyl)-. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone,1-(4,5-dichloro-2-nitrophenyl)-. Following Lipinski's Rule of Five, Ethanone,1-(4,5-dichloro-2-nitrophenyl)- has 0 hydrogen bond donor(s) and 3 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 Ethanone,1-(4,5-dichloro-2-nitrophenyl)-?
The CAS number of Ethanone,1-(4,5-dichloro-2-nitrophenyl)- is 6635-71-8.
What is the molecular formula of Ethanone,1-(4,5-dichloro-2-nitrophenyl)-?
The molecular formula of Ethanone,1-(4,5-dichloro-2-nitrophenyl)- is C8H5Cl2NO3.
What is the molecular weight of Ethanone,1-(4,5-dichloro-2-nitrophenyl)-?
The molecular weight of Ethanone,1-(4,5-dichloro-2-nitrophenyl)- is 232.96 g/mol.
Where can I buy Ethanone,1-(4,5-dichloro-2-nitrophenyl)-?
You can request a quote for Ethanone,1-(4,5-dichloro-2-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone,1-(4,5-dichloro-2-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone,1-(4,5-dichloro-2-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.