2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid
TL;DR: 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid (CAS 96028-18-1) is a chemical compound with molecular formula C11H10Cl2O2 and molecular weight 244.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,2-dichloroethenyl)phenyl]propanoic acid
Also Known As: TA 668, 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid, 2-[4-(2,2-dichloroethenyl)phenyl]propanoic acid, 2-(4-(2,2-DICHLOROVINYL)PHENYL)PROPANOIC ACID, 2-[4-(2,2-Dichloroethen-1-yl)phenyl]propanoic acid
| Molecular Formula | C11H10Cl2O2 |
|---|---|
| Molecular Weight | 244.01 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.00578 |
| Heavy Atoms | 15 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 96028-18-1 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)C=C(Cl)Cl)C(=O)O |
| InChIKey | FZCWHTVESKULLI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid (CAS 96028-18-1), with molecular formula C11H10Cl2O2 and molecular weight 244.01 g/mol. IUPAC: 2-[4-(2,2-dichloroethenyl)phenyl]propanoic acid.
Chemical Property Profile of 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid
Property Insights of 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid
The XLogP value of 3.8 indicates that 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid has 1 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 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid?
The CAS number of 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid is 96028-18-1.
What is the molecular formula of 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid?
The molecular formula of 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid is C11H10Cl2O2.
What is the molecular weight of 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid?
The molecular weight of 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid is 244.01 g/mol.
Where can I buy 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid?
You can request a quote for 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(2,2-Dichlorovinyl)phenyl)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.