(+-)-2-(3-Chlorophenoxy)propionic acid
TL;DR: (+-)-2-(3-Chlorophenoxy)propionic acid (CAS 101-10-0) is a chemical compound with molecular formula C9H9ClO3 and molecular weight 200.02402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-chlorophenoxy)propanoic acid
Also Known As: Cloprop, 2-(3-CHLOROPHENOXY)PROPIONIC ACID, 2-(3-Chlorophenoxy)propanoic acid, Metachlorphenprop, Fruitone CPA
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H9ClO3 |
| Molecular Weight | 200.02402 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.02402 Da |
| Heavy Atoms | 13 |
| Complexity | 184.0 |
| Melting Point | 113 °C |
| Boiling Point | 100 °C at 1.5 mm Hg |
| Vapor Pressure | 0.000228 [mmHg] |
| Solubility | In acetone 790.9, dimethyl sulfoxide 268.5, ethanol 710.8, methanol 716.5, iso-octanol 247.3 (all in g/L, 22 °C. In benzene 24.2, chlorobenzene 17.1, toluene 17.6 (all in g/L, 24 °C). In diethylene glycol 390.6, dimethyl formamide 2,354.5, dioxane 789.2 (all in g/L, 24.5 °C). |
| SMILES | CC(C(=O)O)OC1=CC(=CC=C1)Cl |
| InChIKey | YNTJKQDWYXUTLZ-UHFFFAOYSA-N |
Chemical Property Profile of (+-)-2-(3-Chlorophenoxy)propionic acid
Property Insights of (+-)-2-(3-Chlorophenoxy)propionic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+-)-2-(3-Chlorophenoxy)propionic acid. With a topological polar surface area (TPSA) of 46.5 Ų, (+-)-2-(3-Chlorophenoxy)propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+-)-2-(3-Chlorophenoxy)propionic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (+-)-2-(3-Chlorophenoxy)propionic acid?
The CAS number of (+-)-2-(3-Chlorophenoxy)propionic acid is 101-10-0.
What is the molecular formula of (+-)-2-(3-Chlorophenoxy)propionic acid?
The molecular formula of (+-)-2-(3-Chlorophenoxy)propionic acid is C9H9ClO3.
What is the molecular weight of (+-)-2-(3-Chlorophenoxy)propionic acid?
The molecular weight of (+-)-2-(3-Chlorophenoxy)propionic acid is 200.02402 g/mol.
Where can I buy (+-)-2-(3-Chlorophenoxy)propionic acid?
You can request a quote for (+-)-2-(3-Chlorophenoxy)propionic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (+-)-2-(3-Chlorophenoxy)propionic acid?
Yes, CoreyChem provides custom synthesis services for (+-)-2-(3-Chlorophenoxy)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.