2,2,2',4',5'-Pentachloroacetophenone
TL;DR: 2,2,2',4',5'-Pentachloroacetophenone (CAS 1203-86-7) is a chemical compound with molecular formula C8H3Cl5O and molecular weight 289.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-1-(2,4,5-trichlorophenyl)ethanone
Also Known As: Pentachloroacetophenone, 2,2,2',4',5'-PENTACHLOROACETOPHENONE, 2,4,5-Trichlorophenacylidene chloride, 2,4,5-Trichlorophenacylidene dichloride, 2,2-dichloro-1-(2,4,5-trichlorophenyl)ethanone
| Molecular Formula | C8H3Cl5O |
|---|---|
| Molecular Weight | 289.86 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.8597 |
| Heavy Atoms | 14 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 1203-86-7 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)Cl)Cl)C(=O)C(Cl)Cl |
| InChIKey | WKJXVVFAALGBOH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,2',4',5'-Pentachloroacetophenone (CAS 1203-86-7), with molecular formula C8H3Cl5O and molecular weight 289.86 g/mol. IUPAC: 2,2-dichloro-1-(2,4,5-trichlorophenyl)ethanone.
Chemical Property Profile of 2,2,2',4',5'-Pentachloroacetophenone
Property Insights of 2,2,2',4',5'-Pentachloroacetophenone
The XLogP value of 4.8 indicates that 2,2,2',4',5'-Pentachloroacetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,2,2',4',5'-Pentachloroacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2',4',5'-Pentachloroacetophenone has 0 hydrogen bond donor(s) and 1 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 2,2,2',4',5'-Pentachloroacetophenone?
The CAS number of 2,2,2',4',5'-Pentachloroacetophenone is 1203-86-7.
What is the molecular formula of 2,2,2',4',5'-Pentachloroacetophenone?
The molecular formula of 2,2,2',4',5'-Pentachloroacetophenone is C8H3Cl5O.
What is the molecular weight of 2,2,2',4',5'-Pentachloroacetophenone?
The molecular weight of 2,2,2',4',5'-Pentachloroacetophenone is 289.86 g/mol.
Where can I buy 2,2,2',4',5'-Pentachloroacetophenone?
You can request a quote for 2,2,2',4',5'-Pentachloroacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2',4',5'-Pentachloroacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2',4',5'-Pentachloroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.