2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate
TL;DR: 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate (CAS 59819-52-2) is a chemical compound with molecular formula C8H6Cl5O3P and molecular weight 355.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-[chloro(2,2,2-trichloroethoxy)phosphoryl]oxybenzene
Also Known As: 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate, 2,2,2-Trichloroethyl ester, 1-chloro-2-[chloro(2,2,2-trichloroethoxy)phosphoryl]oxybenzene, 2-chlorophenyl 2,2,2-trichloroethyl phosphorochloridate, (2-CHLOROPHENYL)(2,2,2-TRICHLOROETHYL) CHLOROPHOSPHATE
| Molecular Formula | C8H6Cl5O3P |
|---|---|
| Molecular Weight | 355.85 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.84677 |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 59819-52-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OP(=O)(OCC(Cl)(Cl)Cl)Cl)Cl |
| InChIKey | ORLCYMQZIPSODD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate (CAS 59819-52-2), with molecular formula C8H6Cl5O3P and molecular weight 355.85 g/mol. IUPAC: 1-chloro-2-[chloro(2,2,2-trichloroethoxy)phosphoryl]oxybenzene.
Chemical Property Profile of 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate
Property Insights of 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate
The XLogP value of 4.6 indicates that 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate 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 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate?
The CAS number of 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate is 59819-52-2.
What is the molecular formula of 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate?
The molecular formula of 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate is C8H6Cl5O3P.
What is the molecular weight of 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate?
The molecular weight of 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate is 355.85 g/mol.
Where can I buy 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate?
You can request a quote for 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorophenyl 2,2,2-trichloroethyl chlorophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.