2,4-D Chlorocrotyl ester
TL;DR: 2,4-D Chlorocrotyl ester (CAS 17106-89-7) is a chemical compound with molecular formula C12H11Cl3O3 and molecular weight 307.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-4-chlorobut-2-enyl] 2-(2,4-dichlorophenoxy)acetate
Also Known As: Crotiline, Krotiline, Crotilin, Krotilin, Crotylin
| Molecular Formula | C12H11Cl3O3 |
|---|---|
| Molecular Weight | 307.98 g/mol |
| LogP | 3.7104 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.9774 |
| Heavy Atoms | 18 |
| Complexity | 432.57587 |
Chemical Identifiers
| CAS Number | 17106-89-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)OCC(=O)OC/C=C/CCl |
Product Overview
2,4-D Chlorocrotyl ester (CAS 17106-89-7), with molecular formula C12H11Cl3O3 and molecular weight 307.98 g/mol. IUPAC: [(E)-4-chlorobut-2-enyl] 2-(2,4-dichlorophenoxy)acetate.
Chemical Property Profile of 2,4-D Chlorocrotyl ester
Property Insights of 2,4-D Chlorocrotyl ester
The XLogP value of 3.7104 indicates that 2,4-D Chlorocrotyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 2,4-D Chlorocrotyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-D Chlorocrotyl ester has 0 hydrogen bond donor(s) and 3 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 2,4-D Chlorocrotyl ester?
The CAS number of 2,4-D Chlorocrotyl ester is 17106-89-7.
What is the molecular formula of 2,4-D Chlorocrotyl ester?
The molecular formula of 2,4-D Chlorocrotyl ester is C12H11Cl3O3.
What is the molecular weight of 2,4-D Chlorocrotyl ester?
The molecular weight of 2,4-D Chlorocrotyl ester is 307.98 g/mol.
Where can I buy 2,4-D Chlorocrotyl ester?
You can request a quote for 2,4-D Chlorocrotyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-D Chlorocrotyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,4-D Chlorocrotyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.