Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate
TL;DR: Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate (CAS 53548-33-7) is a chemical compound with molecular formula C10H8Cl2O3 and molecular weight 245.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-(2,4-dichlorophenoxy)prop-2-enoate
Also Known As: Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate, methyl (E)-3-(2,4-dichlorophenoxy)prop-2-enoate, 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, methyl ester, (E)-
| Molecular Formula | C10H8Cl2O3 |
|---|---|
| Molecular Weight | 245.99 g/mol |
| LogP | 3.0589 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.98505 |
| Heavy Atoms | 15 |
| Complexity | 388.25394 |
Chemical Identifiers
| CAS Number | 53548-33-7 |
|---|---|
| SMILES | COC(=O)/C=C/OC1=C(C=C(C=C1)Cl)Cl |
Product Overview
Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate (CAS 53548-33-7), with molecular formula C10H8Cl2O3 and molecular weight 245.99 g/mol. IUPAC: methyl (E)-3-(2,4-dichlorophenoxy)prop-2-enoate.
Chemical Property Profile of Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate
Property Insights of Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate
The XLogP value of 3.0589 indicates that Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate 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 Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate?
The CAS number of Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate is 53548-33-7.
What is the molecular formula of Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate?
The molecular formula of Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate is C10H8Cl2O3.
What is the molecular weight of Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate?
The molecular weight of Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate is 245.99 g/mol.
Where can I buy Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate?
You can request a quote for Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (E)-3-(2,4-dichlorophenoxy)-2-propenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.