1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate
TL;DR: 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate (CAS 6307-95-5) is a chemical compound with molecular formula C13H13Cl3O5 and molecular weight 353.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methoxy-1-oxopropan-2-yl) 2-(2,4,5-trichlorophenoxy)propanoate
Also Known As: 1-methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate, (1-methoxy-1-oxopropan-2-yl) 2-(2,4,5-trichlorophenoxy)propanoate, (1-methoxy-1-oxopropan-2-yl) 2-(2,4,5-trichlorophenoxy)propa, 2-[2-(2,4,5-Trichlor-phenoxy)-propionyloxy]-propionsaeure-methylester, Propanoic acid,2-[1-oxo-2-(2,4,5-trichlorophenoxy)propoxy]-, methyl ester
| Molecular Formula | C13H13Cl3O5 |
|---|---|
| Molecular Weight | 353.98 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 353.98285 |
| Heavy Atoms | 21 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 6307-95-5 |
|---|---|
| SMILES | CC(C(=O)OC(C)C(=O)OC)OC1=CC(=C(C=C1Cl)Cl)Cl |
| InChIKey | IYCQKPMQPNQYHM-UHFFFAOYSA-N |
Product Overview
1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate (CAS 6307-95-5), with molecular formula C13H13Cl3O5 and molecular weight 353.98 g/mol. IUPAC: (1-methoxy-1-oxopropan-2-yl) 2-(2,4,5-trichlorophenoxy)propanoate.
Chemical Property Profile of 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate
Property Insights of 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate
The XLogP value of 4.4 indicates that 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate. Following Lipinski's Rule of Five, 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate 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 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate?
The CAS number of 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate is 6307-95-5.
What is the molecular formula of 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate?
The molecular formula of 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate is C13H13Cl3O5.
What is the molecular weight of 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate?
The molecular weight of 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate is 353.98 g/mol.
Where can I buy 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate?
You can request a quote for 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxy-1-oxopropan-2-yl 2-(2,4,5-trichlorophenoxy)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.