Chloracetophon
TL;DR: Chloracetophon (CAS 74940-61-7) is a chemical compound with molecular formula C6H9Cl4O5P and molecular weight 331.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,2-trichloro-1-dimethoxyphosphorylethyl) 2-chloroacetate
Also Known As: Chloracetophon, Chloracetophone, Chloracetofon, 4-Dimethylamino-diphenylcarbinol, CHLORACETOPHON, (+/-)-
| Molecular Formula | C6H9Cl4O5P |
|---|---|
| Molecular Weight | 331.89 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.89124 |
| Heavy Atoms | 16 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 74940-61-7 |
|---|---|
| SMILES | COP(=O)(C(C(Cl)(Cl)Cl)OC(=O)CCl)OC |
| InChIKey | AHAAWQBSARNIMQ-UHFFFAOYSA-N |
Product Overview
Chloracetophon (CAS 74940-61-7), with molecular formula C6H9Cl4O5P and molecular weight 331.89 g/mol. IUPAC: (2,2,2-trichloro-1-dimethoxyphosphorylethyl) 2-chloroacetate.
Chemical Property Profile of Chloracetophon
Property Insights of Chloracetophon
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloracetophon. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Chloracetophon. Following Lipinski's Rule of Five, Chloracetophon 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 Chloracetophon?
The CAS number of Chloracetophon is 74940-61-7.
What is the molecular formula of Chloracetophon?
The molecular formula of Chloracetophon is C6H9Cl4O5P.
What is the molecular weight of Chloracetophon?
The molecular weight of Chloracetophon is 331.89 g/mol.
Where can I buy Chloracetophon?
You can request a quote for Chloracetophon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloracetophon?
Yes, KEHONG BIO provides custom synthesis services for Chloracetophon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.