Ethyl phenyl 2,4,6-trichlorophenyl phosphate
TL;DR: Ethyl phenyl 2,4,6-trichlorophenyl phosphate (CAS 46791-22-4) is a chemical compound with molecular formula C14H12Cl3O4P and molecular weight 379.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl phenyl (2,4,6-trichlorophenyl) phosphate
Also Known As: Ethyl phenyl 2,4,6-trichlorophenyl phosphate, DL-1-Cyclohexenylglycin, Ethylphenyl2,4,6-trichlorophenylphosphate, ethyl phenyl (2,4,6-trichlorophenyl) phosphate, Phosphoric acid, ethyl phenyl 2,4,6-trichlorophenyl ester
| Molecular Formula | C14H12Cl3O4P |
|---|---|
| Molecular Weight | 379.95 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 379.9539 |
| Heavy Atoms | 22 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 46791-22-4 |
|---|---|
| SMILES | CCOP(=O)(OC1=CC=CC=C1)OC2=C(C=C(C=C2Cl)Cl)Cl |
| InChIKey | MOHMQGLVGUGERE-UHFFFAOYSA-N |
Product Overview
Ethyl phenyl 2,4,6-trichlorophenyl phosphate (CAS 46791-22-4), with molecular formula C14H12Cl3O4P and molecular weight 379.95 g/mol. IUPAC: ethyl phenyl (2,4,6-trichlorophenyl) phosphate.
Chemical Property Profile of Ethyl phenyl 2,4,6-trichlorophenyl phosphate
Property Insights of Ethyl phenyl 2,4,6-trichlorophenyl phosphate
The XLogP value of 5.3 indicates that Ethyl phenyl 2,4,6-trichlorophenyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Ethyl phenyl 2,4,6-trichlorophenyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl phenyl 2,4,6-trichlorophenyl phosphate has 0 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 Ethyl phenyl 2,4,6-trichlorophenyl phosphate?
The CAS number of Ethyl phenyl 2,4,6-trichlorophenyl phosphate is 46791-22-4.
What is the molecular formula of Ethyl phenyl 2,4,6-trichlorophenyl phosphate?
The molecular formula of Ethyl phenyl 2,4,6-trichlorophenyl phosphate is C14H12Cl3O4P.
What is the molecular weight of Ethyl phenyl 2,4,6-trichlorophenyl phosphate?
The molecular weight of Ethyl phenyl 2,4,6-trichlorophenyl phosphate is 379.95 g/mol.
Where can I buy Ethyl phenyl 2,4,6-trichlorophenyl phosphate?
You can request a quote for Ethyl phenyl 2,4,6-trichlorophenyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl phenyl 2,4,6-trichlorophenyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl phenyl 2,4,6-trichlorophenyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.