Methyl 3-(3,4-dichlorophenyl)acrylate
TL;DR: Methyl 3-(3,4-dichlorophenyl)acrylate (CAS 20883-95-8) is a chemical compound with molecular formula C10H8Cl2O2 and molecular weight 229.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-(3,4-dichlorophenyl)prop-2-enoate
Also Known As: Methyl 3-(3,4-dichlorophenyl)acrylate, ghl.PD_Mitscher_leg0.321, ghl.PD_Mitscher_leg0.532, methyl 3,4-dichlorocinnamate, methyl (E)-3-(3,4-dichlorophenyl)prop-2-enoate
| Molecular Formula | C10H8Cl2O2 |
|---|---|
| Molecular Weight | 229.99 g/mol |
| LogP | 3.1796 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.99013 |
| Heavy Atoms | 14 |
| Complexity | 372.3848 |
Chemical Identifiers
| CAS Number | 20883-95-8 |
|---|---|
| SMILES | COC(=O)/C=C/C1=CC(=C(C=C1)Cl)Cl |
Product Overview
Methyl 3-(3,4-dichlorophenyl)acrylate (CAS 20883-95-8), with molecular formula C10H8Cl2O2 and molecular weight 229.99 g/mol. IUPAC: methyl (E)-3-(3,4-dichlorophenyl)prop-2-enoate.
Chemical Property Profile of Methyl 3-(3,4-dichlorophenyl)acrylate
Property Insights of Methyl 3-(3,4-dichlorophenyl)acrylate
The XLogP value of 3.1796 indicates that Methyl 3-(3,4-dichlorophenyl)acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 3-(3,4-dichlorophenyl)acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(3,4-dichlorophenyl)acrylate has 0 hydrogen bond donor(s) and 2 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 3-(3,4-dichlorophenyl)acrylate?
The CAS number of Methyl 3-(3,4-dichlorophenyl)acrylate is 20883-95-8.
What is the molecular formula of Methyl 3-(3,4-dichlorophenyl)acrylate?
The molecular formula of Methyl 3-(3,4-dichlorophenyl)acrylate is C10H8Cl2O2.
What is the molecular weight of Methyl 3-(3,4-dichlorophenyl)acrylate?
The molecular weight of Methyl 3-(3,4-dichlorophenyl)acrylate is 229.99 g/mol.
Where can I buy Methyl 3-(3,4-dichlorophenyl)acrylate?
You can request a quote for Methyl 3-(3,4-dichlorophenyl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(3,4-dichlorophenyl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(3,4-dichlorophenyl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.