3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate
TL;DR: 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate (CAS 16117-38-7) is a chemical compound with molecular formula C17H16Cl3NO3 and molecular weight 387.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate
Also Known As: 3-pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate, 3-(Pyridin-2-yl)propyl 2-(2,4,5-trichlorophenoxy)propanoate
| Molecular Formula | C17H16Cl3NO3 |
|---|---|
| Molecular Weight | 387.02 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 387.01956 |
| Heavy Atoms | 24 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 16117-38-7 |
|---|---|
| SMILES | CC(C(=O)OCCCC1=CC=CC=N1)OC2=CC(=C(C=C2Cl)Cl)Cl |
| InChIKey | WGFOYYPVNZFLMT-UHFFFAOYSA-N |
Product Overview
3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate (CAS 16117-38-7), with molecular formula C17H16Cl3NO3 and molecular weight 387.02 g/mol. IUPAC: 3-pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate.
Chemical Property Profile of 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate
Property Insights of 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate
The XLogP value of 5.4 indicates that 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.4 Ų, 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate 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 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate?
The CAS number of 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate is 16117-38-7.
What is the molecular formula of 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate?
The molecular formula of 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate is C17H16Cl3NO3.
What is the molecular weight of 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate?
The molecular weight of 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate is 387.02 g/mol.
Where can I buy 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate?
You can request a quote for 3-Pyridin-2-ylpropyl 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 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridin-2-ylpropyl 2-(2,4,5-trichlorophenoxy)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.