Trichlorophenyl cyclohexylamido ethyl thiophosphate
TL;DR: Trichlorophenyl cyclohexylamido ethyl thiophosphate (CAS 116295-49-9) is a chemical compound with molecular formula C14H19Cl3NO2PS and molecular weight 400.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[ethoxy-(2,4,5-trichlorophenoxy)phosphinothioyl]cyclohexanamine
Also Known As: Trichlorophenyl cyclohexylamido ethyl thiophosphate, N-[ethoxy-(2,4,5-trichlorophenoxy)phosphinothioyl]cyclohexanamine
| Molecular Formula | C14H19Cl3NO2PS |
|---|---|
| Molecular Weight | 400.99 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.99396 |
| Heavy Atoms | 22 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 116295-49-9 |
|---|---|
| SMILES | CCOP(=S)(NC1CCCCC1)OC2=CC(=C(C=C2Cl)Cl)Cl |
| InChIKey | BNWPHCMSAUZTRF-UHFFFAOYSA-N |
Product Overview
Trichlorophenyl cyclohexylamido ethyl thiophosphate (CAS 116295-49-9), with molecular formula C14H19Cl3NO2PS and molecular weight 400.99 g/mol. IUPAC: N-[ethoxy-(2,4,5-trichlorophenoxy)phosphinothioyl]cyclohexanamine.
Chemical Property Profile of Trichlorophenyl cyclohexylamido ethyl thiophosphate
Property Insights of Trichlorophenyl cyclohexylamido ethyl thiophosphate
The XLogP value of 6.8 indicates that Trichlorophenyl cyclohexylamido ethyl thiophosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Trichlorophenyl cyclohexylamido ethyl thiophosphate. Following Lipinski's Rule of Five, Trichlorophenyl cyclohexylamido ethyl thiophosphate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trichlorophenyl cyclohexylamido ethyl thiophosphate?
The CAS number of Trichlorophenyl cyclohexylamido ethyl thiophosphate is 116295-49-9.
What is the molecular formula of Trichlorophenyl cyclohexylamido ethyl thiophosphate?
The molecular formula of Trichlorophenyl cyclohexylamido ethyl thiophosphate is C14H19Cl3NO2PS.
What is the molecular weight of Trichlorophenyl cyclohexylamido ethyl thiophosphate?
The molecular weight of Trichlorophenyl cyclohexylamido ethyl thiophosphate is 400.99 g/mol.
Where can I buy Trichlorophenyl cyclohexylamido ethyl thiophosphate?
You can request a quote for Trichlorophenyl cyclohexylamido ethyl thiophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichlorophenyl cyclohexylamido ethyl thiophosphate?
Yes, KEHONG BIO provides custom synthesis services for Trichlorophenyl cyclohexylamido ethyl thiophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.