2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-
TL;DR: 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- (CAS 53548-38-2) is a chemical compound with molecular formula C13H14Cl2O3 and molecular weight 288.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl (E)-3-(2,4-dichlorophenoxy)prop-2-enoate
Also Known As: (E)-2-Methylpropyl 3-(2,4-dichlorophenoxy)-2-propenoate, 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-, 2-methylpropyl (E)-3-(2,4-dichlorophenoxy)prop-2-enoate
| Molecular Formula | C13H14Cl2O3 |
|---|---|
| Molecular Weight | 288.03 g/mol |
| LogP | 4.0851 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.032 |
| Heavy Atoms | 18 |
| Complexity | 441.86255 |
Chemical Identifiers
| CAS Number | 53548-38-2 |
|---|---|
| SMILES | CC(C)COC(=O)/C=C/OC1=C(C=C(C=C1)Cl)Cl |
Product Overview
2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- (CAS 53548-38-2), with molecular formula C13H14Cl2O3 and molecular weight 288.03 g/mol. IUPAC: 2-methylpropyl (E)-3-(2,4-dichlorophenoxy)prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-
Property Insights of 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-
The XLogP value of 4.0851 indicates that 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- 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-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- 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-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-?
The CAS number of 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- is 53548-38-2.
What is the molecular formula of 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-?
The molecular formula of 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- is C13H14Cl2O3.
What is the molecular weight of 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-?
The molecular weight of 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- is 288.03 g/mol.
Where can I buy 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-?
You can request a quote for 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 2-methylpropyl ester, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.