3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate
TL;DR: 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate (CAS 6047-17-2) is a chemical compound with molecular formula C16H21Cl3O4 and molecular weight 382.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate
Also Known As: Fenoprop-3-butoxypropyl, Fenoprop-3-butoxypropyl [ISO], 3-butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate, SILVEX, BUTOXY PROPYL ESTER, Propanoic acid, 3-(2,4,5-trichlorophenoxy)-, 3-butoxypropyl ester
| Molecular Formula | C16H21Cl3O4 |
|---|---|
| Molecular Weight | 382.05 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 382.05054 |
| Heavy Atoms | 23 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 6047-17-2 |
|---|---|
| SMILES | CCCCOCCCOC(=O)CCOC1=CC(=C(C=C1Cl)Cl)Cl |
| InChIKey | UFYGEGSDUCLKNR-UHFFFAOYSA-N |
Product Overview
3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate (CAS 6047-17-2), with molecular formula C16H21Cl3O4 and molecular weight 382.05 g/mol. IUPAC: 3-butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate.
Chemical Property Profile of 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate
Property Insights of 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate
The XLogP value of 5.1 indicates that 3-Butoxypropyl 3-(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 44.8 Ų, 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butoxypropyl 3-(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-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate?
The CAS number of 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate is 6047-17-2.
What is the molecular formula of 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate?
The molecular formula of 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate is C16H21Cl3O4.
What is the molecular weight of 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate?
The molecular weight of 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate is 382.05 g/mol.
Where can I buy 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate?
You can request a quote for 3-Butoxypropyl 3-(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-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Butoxypropyl 3-(2,4,5-trichlorophenoxy)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.